Organic compounds
Organic compounds are a class of chemical compounds that contain one or more atoms of carbon covalently bonded to each other and atoms of other elements such as hydrogen, oxygen, nitrogen, sulfur, etc.
Compounds or allotropes of carbon that contain only carbon atoms are classified as inorganic compounds and exhibit novel properties.
This class of chemicals has a wide range of applications and includes graphite, diamond, and the more recently discovered graphene, fullerenes, and other carbon nanotubes. In fact, the majority of elements in the periodic table of elements are inorganic compounds.
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Myosmine, 98%, may contain up to 2% water
CAS: 532-12-7 Molecular Formula: C9H10N2 Molecular Weight (g/mol): 146.193 MDL Number: MFCD00052019 InChI Key: DPNGWXJMIILTBS-UHFFFAOYSA-N Synonym: myosmine,3-3,4-dihydro-2h-pyrrol-5-yl pyridine,3-1-pyrrolin-2-yl pyridine,miosmine,unii-9o0a545w4l,3-4,5-dihydro-3h-pyrrol-2-yl-pyridine,2-3-pyridyl-1-pyrroline,3-2-pyrrolin-2-yl pyridine,pyridine, 3-3,4-dihydro-2h-pyrrol-5-yl,pyridine, 3-1-pyrrolin-2-yl PubChem CID: 442649 ChEBI: CHEBI:7051 IUPAC Name: 3-(3,4-dihydro-2H-pyrrol-5-yl)pyridine SMILES: C1CC(=NC1)C2=CN=CC=C2
| PubChem CID | 442649 |
|---|---|
| CAS | 532-12-7 |
| Molecular Weight (g/mol) | 146.193 |
| ChEBI | CHEBI:7051 |
| MDL Number | MFCD00052019 |
| SMILES | C1CC(=NC1)C2=CN=CC=C2 |
| Synonym | myosmine,3-3,4-dihydro-2h-pyrrol-5-yl pyridine,3-1-pyrrolin-2-yl pyridine,miosmine,unii-9o0a545w4l,3-4,5-dihydro-3h-pyrrol-2-yl-pyridine,2-3-pyridyl-1-pyrroline,3-2-pyrrolin-2-yl pyridine,pyridine, 3-3,4-dihydro-2h-pyrrol-5-yl,pyridine, 3-1-pyrrolin-2-yl |
| IUPAC Name | 3-(3,4-dihydro-2H-pyrrol-5-yl)pyridine |
| InChI Key | DPNGWXJMIILTBS-UHFFFAOYSA-N |
| Molecular Formula | C9H10N2 |
Hexanoyl chloride, 97%
CAS: 142-61-0 Molecular Formula: C6H11ClO Molecular Weight (g/mol): 134.603 MDL Number: MFCD00000760 InChI Key: YWGHUJQYGPDNKT-UHFFFAOYSA-N Synonym: caproyl chloride,n-caproyl chloride,hexanoylchloride,unii-i7ge8hg3b2,n-hexanoyl chloride,caproic acid chloride,hexanoic acid chloride,i7ge8hg3b2,caproylchloride,hexoylchlorid PubChem CID: 67340 IUPAC Name: hexanoyl chloride SMILES: CCCCCC(=O)Cl
| PubChem CID | 67340 |
|---|---|
| CAS | 142-61-0 |
| Molecular Weight (g/mol) | 134.603 |
| MDL Number | MFCD00000760 |
| SMILES | CCCCCC(=O)Cl |
| Synonym | caproyl chloride,n-caproyl chloride,hexanoylchloride,unii-i7ge8hg3b2,n-hexanoyl chloride,caproic acid chloride,hexanoic acid chloride,i7ge8hg3b2,caproylchloride,hexoylchlorid |
| IUPAC Name | hexanoyl chloride |
| InChI Key | YWGHUJQYGPDNKT-UHFFFAOYSA-N |
| Molecular Formula | C6H11ClO |
Stigmasterol, 95%, Thermo Scientific Chemicals
CAS: 83-48-7 Molecular Formula: C29H48O Molecular Weight (g/mol): 412.70 MDL Number: MFCD00003630 InChI Key: HCXVJBMSMIARIN-PHZDYDNGSA-N Synonym: stigmasterol,stigmasterin,beta-stigmasterol,stigmasta-5,22-dien-3beta-ol,24s-5,22-stigmastadien-3beta-ol,unii-99wuk5d0y8,stigmasta-5,22e-dien-3beta-ol,stigmasta-5,22-dien-3-beta-ol,3beta,22e-stigmasta-5,22-dien-3-ol,stigmasta-5,22-dien-3-ol, 3b,22e PubChem CID: 5280794 ChEBI: CHEBI:28824 IUPAC Name: (3S,8S,9S,10R,13R,14S,17R)-17-[(E,2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol SMILES: CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C
| PubChem CID | 5280794 |
|---|---|
| CAS | 83-48-7 |
| Molecular Weight (g/mol) | 412.70 |
| ChEBI | CHEBI:28824 |
| MDL Number | MFCD00003630 |
| SMILES | CC[C@H](\C=C\[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C |
| Synonym | stigmasterol,stigmasterin,beta-stigmasterol,stigmasta-5,22-dien-3beta-ol,24s-5,22-stigmastadien-3beta-ol,unii-99wuk5d0y8,stigmasta-5,22e-dien-3beta-ol,stigmasta-5,22-dien-3-beta-ol,3beta,22e-stigmasta-5,22-dien-3-ol,stigmasta-5,22-dien-3-ol, 3b,22e |
| IUPAC Name | (3S,8S,9S,10R,13R,14S,17R)-17-[(E,2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol |
| InChI Key | HCXVJBMSMIARIN-PHZDYDNGSA-N |
| Molecular Formula | C29H48O |
1,5-Dinitronaphthalene, 97+%
CAS: 605-71-0 Molecular Formula: C10H6N2O4 Molecular Weight (g/mol): 218.168 MDL Number: MFCD00003916 InChI Key: ZUTCJXFCHHDFJS-UHFFFAOYSA-N Synonym: naphthalene, 1,5-dinitro,naphthalene, dinitro,unii-ui2s14iw4t,ccris 6028,ui2s14iw4t,napththalene, 1,5-dinitro,1,5 or 1,8-dinitronaphthalene,acmc-1bixi,1,5-dinitro naphthalene,1,5-dinitro-naphthalene PubChem CID: 11803 ChEBI: CHEBI:50640 IUPAC Name: 1,5-dinitronaphthalene SMILES: C1=CC2=C(C=CC=C2[N+](=O)[O-])C(=C1)[N+](=O)[O-]
| PubChem CID | 11803 |
|---|---|
| CAS | 605-71-0 |
| Molecular Weight (g/mol) | 218.168 |
| ChEBI | CHEBI:50640 |
| MDL Number | MFCD00003916 |
| SMILES | C1=CC2=C(C=CC=C2[N+](=O)[O-])C(=C1)[N+](=O)[O-] |
| Synonym | naphthalene, 1,5-dinitro,naphthalene, dinitro,unii-ui2s14iw4t,ccris 6028,ui2s14iw4t,napththalene, 1,5-dinitro,1,5 or 1,8-dinitronaphthalene,acmc-1bixi,1,5-dinitro naphthalene,1,5-dinitro-naphthalene |
| IUPAC Name | 1,5-dinitronaphthalene |
| InChI Key | ZUTCJXFCHHDFJS-UHFFFAOYSA-N |
| Molecular Formula | C10H6N2O4 |
Carbon powder, activated
CAS: 7440-44-0 Molecular Formula: C MDL Number: MFCD00133992 InChI Key: OKTJSMMVPCPJKN-UHFFFAOYSA-N Synonym: graphite,activated charcoal,norit,mineral,carbon-12,carbono,graphene,acticarbone,anthrasorb,carbosieve PubChem CID: 5462310 ChEBI: CHEBI:27594 IUPAC Name: carbon SMILES: [C]
| PubChem CID | 5462310 |
|---|---|
| CAS | 7440-44-0 |
| ChEBI | CHEBI:27594 |
| MDL Number | MFCD00133992 |
| SMILES | [C] |
| Synonym | graphite,activated charcoal,norit,mineral,carbon-12,carbono,graphene,acticarbone,anthrasorb,carbosieve |
| IUPAC Name | carbon |
| InChI Key | OKTJSMMVPCPJKN-UHFFFAOYSA-N |
| Molecular Formula | C |
1-Propylphosphonic acid cyclic anhydride, 50+% w/w soln. in dichloromethane, Thermo Scientific Chemicals
CAS: 68957-94-8 Molecular Formula: C9H21O6P3 Molecular Weight (g/mol): 318.182 MDL Number: MFCD00006583 InChI Key: PAQZWJGSJMLPMG-UHFFFAOYSA-N Synonym: 2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphorinane-2,4,6-trioxide,1-propanephosphonic acid cyclic anhydride,2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphinane 2,4,6-trioxide,unii-i6egd8839n,1,3,5,2,4,6-trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide,propane phosphonic acid anhydride,2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphorinane 2,4,6-trioxide,1-propanephosphonic anhydride in thf,2,4,6-tri-n-propyl-2,4,6-trioxo-1,3,5,2,4,6-trioxatriphosphorinane,1-propanephosphonic anhydride in toluene,t3p PubChem CID: 111923 IUPAC Name: 2,4,6-tripropyl-1,3,5,2$l^{5},4$l^{5},6$l^{5}-trioxatriphosphinane 2,4,6-trioxide SMILES: CCCP1(=O)OP(=O)(OP(=O)(O1)CCC)CCC
| PubChem CID | 111923 |
|---|---|
| CAS | 68957-94-8 |
| Molecular Weight (g/mol) | 318.182 |
| MDL Number | MFCD00006583 |
| SMILES | CCCP1(=O)OP(=O)(OP(=O)(O1)CCC)CCC |
| Synonym | 2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphorinane-2,4,6-trioxide,1-propanephosphonic acid cyclic anhydride,2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphinane 2,4,6-trioxide,unii-i6egd8839n,1,3,5,2,4,6-trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide,propane phosphonic acid anhydride,2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphorinane 2,4,6-trioxide,1-propanephosphonic anhydride in thf,2,4,6-tri-n-propyl-2,4,6-trioxo-1,3,5,2,4,6-trioxatriphosphorinane,1-propanephosphonic anhydride in toluene,t3p |
| IUPAC Name | 2,4,6-tripropyl-1,3,5,2$l^{5},4$l^{5},6$l^{5}-trioxatriphosphinane 2,4,6-trioxide |
| InChI Key | PAQZWJGSJMLPMG-UHFFFAOYSA-N |
| Molecular Formula | C9H21O6P3 |
Phenol, 99+%, for biochemistry, loose crystals
CAS: 108-95-2 Molecular Formula: C6H6O Molecular Weight (g/mol): 94.11 MDL Number: MFCD00002143 InChI Key: ISWSIDIOOBJBQZ-UHFFFAOYSA-N Synonym: carbolic acid,hydroxybenzene,phenic acid,phenylic acid,oxybenzene,benzenol,phenyl hydrate,monophenol,phenyl hydroxide,phenylic alcohol PubChem CID: 996 ChEBI: CHEBI:15882 IUPAC Name: phenol SMILES: OC1=CC=CC=C1
| PubChem CID | 996 |
|---|---|
| CAS | 108-95-2 |
| Molecular Weight (g/mol) | 94.11 |
| ChEBI | CHEBI:15882 |
| MDL Number | MFCD00002143 |
| SMILES | OC1=CC=CC=C1 |
| Synonym | carbolic acid,hydroxybenzene,phenic acid,phenylic acid,oxybenzene,benzenol,phenyl hydrate,monophenol,phenyl hydroxide,phenylic alcohol |
| IUPAC Name | phenol |
| InChI Key | ISWSIDIOOBJBQZ-UHFFFAOYSA-N |
| Molecular Formula | C6H6O |
Adipoyl chloride, 98%
CAS: 111-50-2 Molecular Formula: C6H8Cl2O2 Molecular Weight (g/mol): 183.03 MDL Number: MFCD00000759 InChI Key: PWAXUOGZOSVGBO-UHFFFAOYSA-N Synonym: adipoyl chloride,adipoyl dichloride,adipyl chloride,adipoylchloride,adipic dichloride,hexanedioyl chloride,adipic acid dichloride,butane-1,4-dicarbonyl chloride,adipic acid chloride,pubchem13242 PubChem CID: 61034 IUPAC Name: hexanedioyl dichloride SMILES: C(CCC(=O)Cl)CC(=O)Cl
| PubChem CID | 61034 |
|---|---|
| CAS | 111-50-2 |
| Molecular Weight (g/mol) | 183.03 |
| MDL Number | MFCD00000759 |
| SMILES | C(CCC(=O)Cl)CC(=O)Cl |
| Synonym | adipoyl chloride,adipoyl dichloride,adipyl chloride,adipoylchloride,adipic dichloride,hexanedioyl chloride,adipic acid dichloride,butane-1,4-dicarbonyl chloride,adipic acid chloride,pubchem13242 |
| IUPAC Name | hexanedioyl dichloride |
| InChI Key | PWAXUOGZOSVGBO-UHFFFAOYSA-N |
| Molecular Formula | C6H8Cl2O2 |
Scopoletin, 95%
CAS: 92-61-5 Molecular Formula: C10H8O4 Molecular Weight (g/mol): 192.17 MDL Number: MFCD00006872 InChI Key: RODXRVNMMDRFIK-UHFFFAOYSA-N Synonym: scopoletin,gelseminic acid,6-methylesculetin,7-hydroxy-6-methoxy-2h-chromen-2-one,chrysatropic acid,scopoletine,murrayetin,scopoletol,7-hydroxy-6-methoxycoumarin,6-o-methylesculetin PubChem CID: 5280460 ChEBI: CHEBI:17488 IUPAC Name: 7-hydroxy-6-methoxychromen-2-one SMILES: COC1=C(C=C2C(=C1)C=CC(=O)O2)O
| PubChem CID | 5280460 |
|---|---|
| CAS | 92-61-5 |
| Molecular Weight (g/mol) | 192.17 |
| ChEBI | CHEBI:17488 |
| MDL Number | MFCD00006872 |
| SMILES | COC1=C(C=C2C(=C1)C=CC(=O)O2)O |
| Synonym | scopoletin,gelseminic acid,6-methylesculetin,7-hydroxy-6-methoxy-2h-chromen-2-one,chrysatropic acid,scopoletine,murrayetin,scopoletol,7-hydroxy-6-methoxycoumarin,6-o-methylesculetin |
| IUPAC Name | 7-hydroxy-6-methoxychromen-2-one |
| InChI Key | RODXRVNMMDRFIK-UHFFFAOYSA-N |
| Molecular Formula | C10H8O4 |
p-Coumaric Acid, 98+%, (Crystalline), MP Biomedicals
CAS: 7400-08-0 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 InChI Key: NGSWKAQJJWESNS-ZZXKWVIFSA-N Synonym: p-coumaric acid,4-hydroxycinnamic acid,p-hydroxycinnamic acid,4-coumaric acid,trans-4-hydroxycinnamic acid,trans-p-coumaric acid,p-cumaric acid,3-4-hydroxyphenyl acrylic acid,para-coumaric acid,hydroxycinnamic acid PubChem CID: 637542 ChEBI: CHEBI:32374 IUPAC Name: (E)-3-(4-hydroxyphenyl)prop-2-enoic acid SMILES: C1=CC(=CC=C1C=CC(=O)O)O
| PubChem CID | 637542 |
|---|---|
| CAS | 7400-08-0 |
| Molecular Weight (g/mol) | 164.16 |
| ChEBI | CHEBI:32374 |
| SMILES | C1=CC(=CC=C1C=CC(=O)O)O |
| Synonym | p-coumaric acid,4-hydroxycinnamic acid,p-hydroxycinnamic acid,4-coumaric acid,trans-4-hydroxycinnamic acid,trans-p-coumaric acid,p-cumaric acid,3-4-hydroxyphenyl acrylic acid,para-coumaric acid,hydroxycinnamic acid |
| IUPAC Name | (E)-3-(4-hydroxyphenyl)prop-2-enoic acid |
| InChI Key | NGSWKAQJJWESNS-ZZXKWVIFSA-N |
| Molecular Formula | C9H8O3 |
1-Chloromethyl-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane bis(tetrafluoroborate), 96%
CAS: 140681-55-6 Molecular Formula: C7H14B2ClF9N2 Molecular Weight (g/mol): 354.26 MDL Number: MFCD00142607 InChI Key: TXRPHPUGYLSHCX-UHFFFAOYSA-N Synonym: selectfluor,1-chloromethyl-4-fluoro-1,4-diazoniabicyclo 2.2.2 octane bis tetrafluoroborate,f-teda-bf4,1-chloromethyl-4-fluoro-1,4-diazabicyclo 2.2.2 octane-1,4-diium tetrafluoroborate,unii-4p1za6r76d,selectfluor fluorinating reagent,f-teda,selectfluor r fluorinating reagent,1-chloromethyl-4-fluoro-1,4-diazoniabicyclo 2.2.2 octane ditetrafluoroborate PubChem CID: 2724933 IUPAC Name: 1-(chloromethyl)-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane;ditetrafluoroborate SMILES: F[B-](F)(F)F.F[B-](F)(F)F.F[N+]12CC[N+](CCl)(CC1)CC2
| PubChem CID | 2724933 |
|---|---|
| CAS | 140681-55-6 |
| Molecular Weight (g/mol) | 354.26 |
| MDL Number | MFCD00142607 |
| SMILES | F[B-](F)(F)F.F[B-](F)(F)F.F[N+]12CC[N+](CCl)(CC1)CC2 |
| Synonym | selectfluor,1-chloromethyl-4-fluoro-1,4-diazoniabicyclo 2.2.2 octane bis tetrafluoroborate,f-teda-bf4,1-chloromethyl-4-fluoro-1,4-diazabicyclo 2.2.2 octane-1,4-diium tetrafluoroborate,unii-4p1za6r76d,selectfluor fluorinating reagent,f-teda,selectfluor r fluorinating reagent,1-chloromethyl-4-fluoro-1,4-diazoniabicyclo 2.2.2 octane ditetrafluoroborate |
| IUPAC Name | 1-(chloromethyl)-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane;ditetrafluoroborate |
| InChI Key | TXRPHPUGYLSHCX-UHFFFAOYSA-N |
| Molecular Formula | C7H14B2ClF9N2 |
Thermo Scientific Chemicals Melatonine, 99%
CAS: 73-31-4 Molecular Formula: C13H16N2O2 Molecular Weight (g/mol): 232.28 MDL Number: MFCD00005655 InChI Key: DRLFMBDRBRZALE-UHFFFAOYSA-N Synonym: melatonin,melatonine,n-acetyl-5-methoxytryptamine,circadin,5-methoxy-n-acetyltryptamine,n-2-5-methoxy-1h-indol-3-yl ethyl acetamide,melatol,melatonex,melovine PubChem CID: 896 ChEBI: CHEBI:16796 IUPAC Name: N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide SMILES: CC(=O)NCCC1=CNC2=C1C=C(C=C2)OC
| PubChem CID | 896 |
|---|---|
| CAS | 73-31-4 |
| Molecular Weight (g/mol) | 232.28 |
| ChEBI | CHEBI:16796 |
| MDL Number | MFCD00005655 |
| SMILES | CC(=O)NCCC1=CNC2=C1C=C(C=C2)OC |
| Synonym | melatonin,melatonine,n-acetyl-5-methoxytryptamine,circadin,5-methoxy-n-acetyltryptamine,n-2-5-methoxy-1h-indol-3-yl ethyl acetamide,melatol,melatonex,melovine |
| IUPAC Name | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide |
| InChI Key | DRLFMBDRBRZALE-UHFFFAOYSA-N |
| Molecular Formula | C13H16N2O2 |
1,10-Phenanthroline, 99%, may contain up to 1.5% water
CAS: 66-71-7 Molecular Formula: C12H8N2 Molecular Weight (g/mol): 180.21 MDL Number: MFCD00011678 InChI Key: DGEZNRSVGBDHLK-UHFFFAOYSA-N Synonym: o-phenanthroline,4,5-diazaphenanthrene,orthophenanthroline,phenanthroline,1,10-o-phenanthroline,phen,2-phenanthroline,beta-phenanthroline,.beta.-phenanthroline PubChem CID: 1318 ChEBI: CHEBI:44975 IUPAC Name: 1,10-phenanthroline SMILES: C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1
| PubChem CID | 1318 |
|---|---|
| CAS | 66-71-7 |
| Molecular Weight (g/mol) | 180.21 |
| ChEBI | CHEBI:44975 |
| MDL Number | MFCD00011678 |
| SMILES | C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1 |
| Synonym | o-phenanthroline,4,5-diazaphenanthrene,orthophenanthroline,phenanthroline,1,10-o-phenanthroline,phen,2-phenanthroline,beta-phenanthroline,.beta.-phenanthroline |
| IUPAC Name | 1,10-phenanthroline |
| InChI Key | DGEZNRSVGBDHLK-UHFFFAOYSA-N |
| Molecular Formula | C12H8N2 |
1,1'-Carbonyldiimidazole 97.0+%, TCI America™
CAS: 530-62-1 Molecular Formula: C7H6N4O Molecular Weight (g/mol): 162.15 MDL Number: MFCD00005286 InChI Key: PFKFTWBEEFSNDU-UHFFFAOYSA-N Synonym: 1,1'-carbonyldiimidazole,n,n'-carbonyldiimidazole,carbonyldiimidazole,di 1h-imidazol-1-yl methanone,n,n-carbonyldiimidazole,1h-imidazole, 1,1'-carbonylbis,1,1'-carbonylbis-1h-imidazole,carbonyl diimidazole,diimidazol-1-yl ketone,1,1-carbonyldiimidazole PubChem CID: 68263 IUPAC Name: 1-(1H-imidazole-1-carbonyl)-1H-imidazole SMILES: O=C(N1C=CN=C1)N1C=CN=C1
| PubChem CID | 68263 |
|---|---|
| CAS | 530-62-1 |
| Molecular Weight (g/mol) | 162.15 |
| MDL Number | MFCD00005286 |
| SMILES | O=C(N1C=CN=C1)N1C=CN=C1 |
| Synonym | 1,1'-carbonyldiimidazole,n,n'-carbonyldiimidazole,carbonyldiimidazole,di 1h-imidazol-1-yl methanone,n,n-carbonyldiimidazole,1h-imidazole, 1,1'-carbonylbis,1,1'-carbonylbis-1h-imidazole,carbonyl diimidazole,diimidazol-1-yl ketone,1,1-carbonyldiimidazole |
| IUPAC Name | 1-(1H-imidazole-1-carbonyl)-1H-imidazole |
| InChI Key | PFKFTWBEEFSNDU-UHFFFAOYSA-N |
| Molecular Formula | C7H6N4O |
1-Cyclohexyl-3-(2-morpholinoethyl)carbodiimide metho-p-toluenesulfonate, 95%
CAS: 2491-17-0 Molecular Formula: C21H33N3O4S Molecular Weight (g/mol): 423.57 MDL Number: MFCD00011979 InChI Key: GBCAVSYHPPARHX-UHFFFAOYSA-M Synonym: cme-carbodiimide,morpho cdi,1-cyclohexyl 3-2-morpholinoethyl carbodiimide methotosylate,4-2-cyclohexylimino methylene amino ethyl-4-methylmorpholin-4-ium 4-methylbenzenesulfonate,cmc,1-cyclohexyl-3-2-morpholinoethyl carbodiimide metho-p-toluenesulfonate,n-cyclohexyl-n'-2-morpholinoethyl carbodiimide metho-p-toluenesulfonate,cmc n-cyclohexyl-n-2-morpholinoethyl carbodiimide metho-p-toluenesulfonate,chm van,4-5-cyclohexyl-3,5-diazapenta-3,4-dienyl-4-methylmorpholine, 4-methylbenzene sulfonic acid PubChem CID: 17220 IUPAC Name: N'-cyclohexyl-N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]methanediimine;4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S([O-])(=O)=O.C[N+]1(CCN=C=NC2CCCCC2)CCOCC1
| PubChem CID | 17220 |
|---|---|
| CAS | 2491-17-0 |
| Molecular Weight (g/mol) | 423.57 |
| MDL Number | MFCD00011979 |
| SMILES | CC1=CC=C(C=C1)S([O-])(=O)=O.C[N+]1(CCN=C=NC2CCCCC2)CCOCC1 |
| Synonym | cme-carbodiimide,morpho cdi,1-cyclohexyl 3-2-morpholinoethyl carbodiimide methotosylate,4-2-cyclohexylimino methylene amino ethyl-4-methylmorpholin-4-ium 4-methylbenzenesulfonate,cmc,1-cyclohexyl-3-2-morpholinoethyl carbodiimide metho-p-toluenesulfonate,n-cyclohexyl-n'-2-morpholinoethyl carbodiimide metho-p-toluenesulfonate,cmc n-cyclohexyl-n-2-morpholinoethyl carbodiimide metho-p-toluenesulfonate,chm van,4-5-cyclohexyl-3,5-diazapenta-3,4-dienyl-4-methylmorpholine, 4-methylbenzene sulfonic acid |
| IUPAC Name | N'-cyclohexyl-N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]methanediimine;4-methylbenzenesulfonate |
| InChI Key | GBCAVSYHPPARHX-UHFFFAOYSA-M |
| Molecular Formula | C21H33N3O4S |