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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beta-Glycerophosphoric acid, disodium salt pentahydrate, 98%
CAS: 13408-09-8 Molecular Formula: C3H19Na2O11P Molecular Weight (g/mol): 308.13 MDL Number: MFCD00149083,MFCD00002135,MFCD00149083,MFCD00149084,MFCD00002135 InChI Key: VWVLGHQKEJESPW-UHFFFAOYSA-N Synonym: unii-5jiy5mmx0e,5jiy5mmx0e,sodium 2-glycerophosphate pentahydrate,sodium beta-glycerophosphate pentahydrate,sodium 1,3-dihydroxypropan-2-yl phosphate pentahydrate,glycerol 2-phosphate,c3h7na2o6p.5h2o,beta-glycerophosphate, disodium salt, pentahydrate,beta-glycerol phosphate disodium salt pentahydrate,beta-glycerophosphoric acid disodium salt pentahydrate PubChem CID: 131846916 IUPAC Name: 1,3-dihydroxypropan-2-yl dihydrogen phosphate;sodium;pentahydrate SMILES: O.O.O.O.O.[Na].[Na].OCC(CO)OP(O)(O)=O
| PubChem CID | 131846916 |
|---|---|
| CAS | 13408-09-8 |
| Molecular Weight (g/mol) | 308.13 |
| MDL Number | MFCD00149083,MFCD00002135,MFCD00149083,MFCD00149084,MFCD00002135 |
| SMILES | O.O.O.O.O.[Na].[Na].OCC(CO)OP(O)(O)=O |
| Synonym | unii-5jiy5mmx0e,5jiy5mmx0e,sodium 2-glycerophosphate pentahydrate,sodium beta-glycerophosphate pentahydrate,sodium 1,3-dihydroxypropan-2-yl phosphate pentahydrate,glycerol 2-phosphate,c3h7na2o6p.5h2o,beta-glycerophosphate, disodium salt, pentahydrate,beta-glycerol phosphate disodium salt pentahydrate,beta-glycerophosphoric acid disodium salt pentahydrate |
| IUPAC Name | 1,3-dihydroxypropan-2-yl dihydrogen phosphate;sodium;pentahydrate |
| InChI Key | VWVLGHQKEJESPW-UHFFFAOYSA-N |
| Molecular Formula | C3H19Na2O11P |
| CAS | 9000-01-5 |
|---|---|
| MDL Number | MFCD00081264 |
| Synonym | Acacia |
Rivaroxaban, 98%
CAS: 366789-02-8 Molecular Formula: C19H18ClN3O5S Molecular Weight (g/mol): 435.88 MDL Number: MFCD11974010 InChI Key: KGFYHTZWPPHNLQ-UHFFFAOYNA-N Synonym: rivaroxaban,xarelto,s-5-chloro-n-2-oxo-3-4-3-oxomorpholino phenyl oxazolidin-5-yl methyl thiophene-2-carboxamide,unii-9ndf7jz4m3,xarelto tn,9ndf7jz4m3,5-chloro-n-5s-2-oxo-3-4-3-oxomorpholin-4-yl phenyl-1,3-oxazolidin-5-yl methyl thiophene-2-carboxamide,2-thiophenecarboxamide, 5-chloro-n-5s-2-oxo-3-4-3-oxo-4-morpholinyl phenyl-5-oxazolidinyl methyl,5-chloro-n-5s-2-oxo-3-4-3-oxo-4-morpholinyl phenyl-5-oxazolidinyl methyl-2-thiophenecarboxamide PubChem CID: 9875401 ChEBI: CHEBI:68579 IUPAC Name: 5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide SMILES: ClC1=CC=C(S1)C(=O)NCC1CN(C(=O)O1)C1=CC=C(C=C1)N1CCOCC1=O
| PubChem CID | 9875401 |
|---|---|
| CAS | 366789-02-8 |
| Molecular Weight (g/mol) | 435.88 |
| ChEBI | CHEBI:68579 |
| MDL Number | MFCD11974010 |
| SMILES | ClC1=CC=C(S1)C(=O)NCC1CN(C(=O)O1)C1=CC=C(C=C1)N1CCOCC1=O |
| Synonym | rivaroxaban,xarelto,s-5-chloro-n-2-oxo-3-4-3-oxomorpholino phenyl oxazolidin-5-yl methyl thiophene-2-carboxamide,unii-9ndf7jz4m3,xarelto tn,9ndf7jz4m3,5-chloro-n-5s-2-oxo-3-4-3-oxomorpholin-4-yl phenyl-1,3-oxazolidin-5-yl methyl thiophene-2-carboxamide,2-thiophenecarboxamide, 5-chloro-n-5s-2-oxo-3-4-3-oxo-4-morpholinyl phenyl-5-oxazolidinyl methyl,5-chloro-n-5s-2-oxo-3-4-3-oxo-4-morpholinyl phenyl-5-oxazolidinyl methyl-2-thiophenecarboxamide |
| IUPAC Name | 5-chloro-N-[[(5S)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]thiophene-2-carboxamide |
| InChI Key | KGFYHTZWPPHNLQ-UHFFFAOYNA-N |
| Molecular Formula | C19H18ClN3O5S |
Thermo Scientific Chemicals Apixaban
CAS: 503612-47-3 Molecular Formula: C25H25N5O4 Molecular Weight (g/mol): 459.51 InChI Key: QNZCBYKSOIHPEH-UHFFFAOYSA-N IUPAC Name: 1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine-3-carboxamide SMILES: COC1=CC=C(C=C1)N1N=C(C(N)=O)C2=C1C(=O)N(CC2)C1=CC=C(C=C1)N1CCCCC1=O
| CAS | 503612-47-3 |
|---|---|
| Molecular Weight (g/mol) | 459.51 |
| SMILES | COC1=CC=C(C=C1)N1N=C(C(N)=O)C2=C1C(=O)N(CC2)C1=CC=C(C=C1)N1CCCCC1=O |
| IUPAC Name | 1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine-3-carboxamide |
| InChI Key | QNZCBYKSOIHPEH-UHFFFAOYSA-N |
| Molecular Formula | C25H25N5O4 |
| PubChem CID | 113227 |
|---|---|
| CAS | 867-56-1 |
| Molecular Weight (g/mol) | 112.06 |
| MDL Number | MFCD00066576 |
| SMILES | CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2C(=O)O.Cl |
| Synonym | methyl red hydrochloride,unii-rfa0w63690,4-dimethylaminoazobenzene-2'-carboxylic acid hydrochloride,eaetho masculinei 2,methyl red, acs,2-4-dimethylamino phenyl azo benzoic acid monohydrochloride,c15h15n3o2.hcl,2-e-4-dimethylamino phenyl diazenyl benzoic acid hydrochloride 1:1,methyl red hydrochloride, acs reagent,2-4-dimethylaminophenyl diazenyl benzoic acid hydrochloride |
| IUPAC Name | 2-[[4-(dimethylamino)phenyl]diazenyl]benzoic acid;hydrochloride |
| InChI Key | ICTWKXAVJAHRMK-UHFFFAOYSA-N |
| Molecular Formula | C3H5NaO3 |
Pentafluoropropionic acid, 97%
CAS: 422-64-0 Molecular Formula: C3HF5O2 Molecular Weight (g/mol): 164.03 MDL Number: MFCD00004170 InChI Key: LRMSQVBRUNSOJL-UHFFFAOYSA-N Synonym: pentafluoropropionic acid,perfluoropropionic acid,pentafluoropropanoic acid,propanoic acid, pentafluoro,propionic acid, pentafluoro,2,2,3,3,3-pentafluoropropionic acid,ipc-pffa-3,perfluoropropanoic acid,propanoic acid, 2,2,3,3,3-pentafluoro,perfluoropropionicacid PubChem CID: 62356 SMILES: OC(=O)C(F)(F)C(F)(F)F
| PubChem CID | 62356 |
|---|---|
| CAS | 422-64-0 |
| Molecular Weight (g/mol) | 164.03 |
| MDL Number | MFCD00004170 |
| SMILES | OC(=O)C(F)(F)C(F)(F)F |
| Synonym | pentafluoropropionic acid,perfluoropropionic acid,pentafluoropropanoic acid,propanoic acid, pentafluoro,propionic acid, pentafluoro,2,2,3,3,3-pentafluoropropionic acid,ipc-pffa-3,perfluoropropanoic acid,propanoic acid, 2,2,3,3,3-pentafluoro,perfluoropropionicacid |
| InChI Key | LRMSQVBRUNSOJL-UHFFFAOYSA-N |
| Molecular Formula | C3HF5O2 |
3-[Bis(2-hydroxyethyl)amino]-2-hydroxypropanesulfonic acid, 99%
CAS: 68399-80-4 Molecular Formula: C7H17NO6S Molecular Weight (g/mol): 243.274 MDL Number: MFCD00038353 InChI Key: XCBLFURAFHFFJF-UHFFFAOYSA-N Synonym: dipso,3-bis 2-hydroxyethyl amino-2-hydroxypropane-1-sulfonic acid,3-n,n-bis 2-hydroxyethyl amino-2-hydroxypropanesulfonic acid,3-n,n-bis 2-hydroxyethyl amino-2-hydroxy-1-propanesulfonic acid,1-propanesulfonic acid, 3-bis 2-hydroxyethyl amino-2-hydroxy,3-bis 2-hydroxyethyl amino-2-hydroxypropanesulfonic acid,3-bis 2-hydroxyethyl amino-2-hydroxy-1-propanesulfonic acid,n,n-bis 2-hydroxyethyl-3-amino-2-hydroxypropanesulfonic acid PubChem CID: 100210 IUPAC Name: 3-[bis(2-hydroxyethyl)amino]-2-hydroxypropane-1-sulfonic acid SMILES: C(CO)N(CCO)CC(CS(=O)(=O)O)O
| PubChem CID | 100210 |
|---|---|
| CAS | 68399-80-4 |
| Molecular Weight (g/mol) | 243.274 |
| MDL Number | MFCD00038353 |
| SMILES | C(CO)N(CCO)CC(CS(=O)(=O)O)O |
| Synonym | dipso,3-bis 2-hydroxyethyl amino-2-hydroxypropane-1-sulfonic acid,3-n,n-bis 2-hydroxyethyl amino-2-hydroxypropanesulfonic acid,3-n,n-bis 2-hydroxyethyl amino-2-hydroxy-1-propanesulfonic acid,1-propanesulfonic acid, 3-bis 2-hydroxyethyl amino-2-hydroxy,3-bis 2-hydroxyethyl amino-2-hydroxypropanesulfonic acid,3-bis 2-hydroxyethyl amino-2-hydroxy-1-propanesulfonic acid,n,n-bis 2-hydroxyethyl-3-amino-2-hydroxypropanesulfonic acid |
| IUPAC Name | 3-[bis(2-hydroxyethyl)amino]-2-hydroxypropane-1-sulfonic acid |
| InChI Key | XCBLFURAFHFFJF-UHFFFAOYSA-N |
| Molecular Formula | C7H17NO6S |
Poly(propylene glycol), average M.W. 425
CAS: 25322-69-4 Molecular Formula: (C3H6O)n Molecular Weight (g/mol): 134.18 MDL Number: MFCD00084446 InChI Key: DNIAPMSPPWPWGF-UHFFFAOYNA-N Synonym: polypropylene glycol,polyoxypropylene,2-2-hydroxypropoxy propan-1-ol,emkapyl,lineartop e,niax ppg,polyoxypropylene glycol,methyloxirane homopolymer,desmophen 360c,2-2-hydroxypropoxy-1-propanol PubChem CID: 32881 IUPAC Name: 2-(2-hydroxypropoxy)propan-1-ol SMILES: [H]OC(C)CO
| PubChem CID | 32881 |
|---|---|
| CAS | 25322-69-4 |
| Molecular Weight (g/mol) | 134.18 |
| MDL Number | MFCD00084446 |
| SMILES | [H]OC(C)CO |
| Synonym | polypropylene glycol,polyoxypropylene,2-2-hydroxypropoxy propan-1-ol,emkapyl,lineartop e,niax ppg,polyoxypropylene glycol,methyloxirane homopolymer,desmophen 360c,2-2-hydroxypropoxy-1-propanol |
| IUPAC Name | 2-(2-hydroxypropoxy)propan-1-ol |
| InChI Key | DNIAPMSPPWPWGF-UHFFFAOYNA-N |
| Molecular Formula | (C3H6O)n |
2,6-Diacetylpyridine, 99%
CAS: 1129-30-2 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.18 MDL Number: MFCD00006304 InChI Key: BEZVGIHGZPLGBL-UHFFFAOYSA-N Synonym: 2,6-diacetylpyridine,1,1'-pyridine-2,6-diyl diethanone,1-6-acetylpyridin-2-yl ethanone,pyridine-2,6-diacetyl,2,6-diacetyl pyridine,1-6-acetyl-pyridin-2-yl-ethanone,ethanone, 1,1'-2,6-pyridinediyl bis,1-6-acetylpyridin-2-yl ethan-1-one,2,6diacetylpyridine,pubchem3144 PubChem CID: 70790 IUPAC Name: 1-(6-acetylpyridin-2-yl)ethanone SMILES: CC(=O)C1=CC=CC(=N1)C(C)=O
| PubChem CID | 70790 |
|---|---|
| CAS | 1129-30-2 |
| Molecular Weight (g/mol) | 163.18 |
| MDL Number | MFCD00006304 |
| SMILES | CC(=O)C1=CC=CC(=N1)C(C)=O |
| Synonym | 2,6-diacetylpyridine,1,1'-pyridine-2,6-diyl diethanone,1-6-acetylpyridin-2-yl ethanone,pyridine-2,6-diacetyl,2,6-diacetyl pyridine,1-6-acetyl-pyridin-2-yl-ethanone,ethanone, 1,1'-2,6-pyridinediyl bis,1-6-acetylpyridin-2-yl ethan-1-one,2,6diacetylpyridine,pubchem3144 |
| IUPAC Name | 1-(6-acetylpyridin-2-yl)ethanone |
| InChI Key | BEZVGIHGZPLGBL-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO2 |
Pyrrolidine, 99+%
CAS: 123-75-1 Molecular Formula: C4H9N Molecular Weight (g/mol): 71.12 MDL Number: MFCD00005249 InChI Key: RWRDLPDLKQPQOW-UHFFFAOYSA-N Synonym: tetrahydropyrrole,tetrahydro pyrrole,azacyclopentane,azolidine,tetramethylenimine,butylenimine,perhydropyrrole,prolamine,1-azacyclopentane,tetramethyleneimine PubChem CID: 31268 ChEBI: CHEBI:33135 IUPAC Name: pyrrolidine SMILES: C1CCNC1
| PubChem CID | 31268 |
|---|---|
| CAS | 123-75-1 |
| Molecular Weight (g/mol) | 71.12 |
| ChEBI | CHEBI:33135 |
| MDL Number | MFCD00005249 |
| SMILES | C1CCNC1 |
| Synonym | tetrahydropyrrole,tetrahydro pyrrole,azacyclopentane,azolidine,tetramethylenimine,butylenimine,perhydropyrrole,prolamine,1-azacyclopentane,tetramethyleneimine |
| IUPAC Name | pyrrolidine |
| InChI Key | RWRDLPDLKQPQOW-UHFFFAOYSA-N |
| Molecular Formula | C4H9N |
n-Butylcyclohexane, 99%
CAS: 1678-93-9 Molecular Formula: C10H20 Molecular Weight (g/mol): 140.27 MDL Number: MFCD00001530 InChI Key: GGBJHURWWWLEQH-UHFFFAOYSA-N Synonym: n-butylcyclohexane,1-cyclohexylbutane,cyclohexane, butyl,butyl-cyclohexane,butane, 1-cyclohexyl,n-butyl-cyclohexane,1-cyclohexyl-butane,cyclohexane, n-butyl,acmc-20aj43,butylcyclohexane PubChem CID: 15506 IUPAC Name: butylcyclohexane SMILES: CCCCC1CCCCC1
| PubChem CID | 15506 |
|---|---|
| CAS | 1678-93-9 |
| Molecular Weight (g/mol) | 140.27 |
| MDL Number | MFCD00001530 |
| SMILES | CCCCC1CCCCC1 |
| Synonym | n-butylcyclohexane,1-cyclohexylbutane,cyclohexane, butyl,butyl-cyclohexane,butane, 1-cyclohexyl,n-butyl-cyclohexane,1-cyclohexyl-butane,cyclohexane, n-butyl,acmc-20aj43,butylcyclohexane |
| IUPAC Name | butylcyclohexane |
| InChI Key | GGBJHURWWWLEQH-UHFFFAOYSA-N |
| Molecular Formula | C10H20 |
Di-^m-bromobis(tri-tert-butylphosphine)dipalladium(I)
CAS: 185812-86-6 Molecular Formula: C24H56Br2P2Pd2 Molecular Weight (g/mol): 779.31 MDL Number: MFCD04114019 InChI Key: JWWUTWDBVLEWDQ-UHFFFAOYSA-P Synonym: palladium i tri-tert-butylphosphine bromide,acmc-1c5o0,qmkdjymohbicon-uhfffaoysa-m,palladium i tri-tertbutylphosphine bromide PubChem CID: 71317307 IUPAC Name: bis(tri-tert-butyl-λ⁵-phosphanyl)cyclodipalladabromane SMILES: CC(C)(C)P([Pd]1[Br][Pd]([Br]1)P(C(C)(C)C)(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C
| PubChem CID | 71317307 |
|---|---|
| CAS | 185812-86-6 |
| Molecular Weight (g/mol) | 779.31 |
| MDL Number | MFCD04114019 |
| SMILES | CC(C)(C)P([Pd]1[Br][Pd]([Br]1)P(C(C)(C)C)(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C |
| Synonym | palladium i tri-tert-butylphosphine bromide,acmc-1c5o0,qmkdjymohbicon-uhfffaoysa-m,palladium i tri-tertbutylphosphine bromide |
| IUPAC Name | bis(tri-tert-butyl-λ⁵-phosphanyl)cyclodipalladabromane |
| InChI Key | JWWUTWDBVLEWDQ-UHFFFAOYSA-P |
| Molecular Formula | C24H56Br2P2Pd2 |
Triethanolamine, ∽99%, MP Biomedicals™
CAS: 102-71-6 Molecular Formula: C6H15NO3 Molecular Weight (g/mol): 149.19 MDL Number: MFCD00002855 InChI Key: GSEJCLTVZPLZKY-UHFFFAOYSA-N Synonym: triethanolamine,trolamine,2,2',2-nitrilotriethanol,sterolamide,daltogen,tris 2-hydroxyethyl amine,triethylolamine,nitrilotriethanol,trihydroxytriethylamine,thiofaco t-35 PubChem CID: 7618 ChEBI: CHEBI:28621 IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethan-1-ol SMILES: OCCN(CCO)CCO
| PubChem CID | 7618 |
|---|---|
| CAS | 102-71-6 |
| Molecular Weight (g/mol) | 149.19 |
| ChEBI | CHEBI:28621 |
| MDL Number | MFCD00002855 |
| SMILES | OCCN(CCO)CCO |
| Synonym | triethanolamine,trolamine,2,2',2-nitrilotriethanol,sterolamide,daltogen,tris 2-hydroxyethyl amine,triethylolamine,nitrilotriethanol,trihydroxytriethylamine,thiofaco t-35 |
| IUPAC Name | 2-[bis(2-hydroxyethyl)amino]ethan-1-ol |
| InChI Key | GSEJCLTVZPLZKY-UHFFFAOYSA-N |
| Molecular Formula | C6H15NO3 |
Ethylene glycol dimethacrylate, 98%, stab. with 100ppm 4-methoxyphenol
CAS: 97-90-5 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.22 MDL Number: MFCD00008590 InChI Key: STVZJERGLQHEKB-UHFFFAOYSA-N Synonym: ethylene glycol dimethacrylate,ethylene dimethacrylate,glycol dimethacrylate,diglycol dimethacrylate,ethanediol dimethacrylate,ethylenedimethyacrylate,ethylene methacrylate,ethyldiol metacrylate,1,2-bis methacryloyloxy ethane,ethylene glycol bis methacrylate PubChem CID: 7355 ChEBI: CHEBI:53436 IUPAC Name: 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OCCOC(=O)C(C)=C
| PubChem CID | 7355 |
|---|---|
| CAS | 97-90-5 |
| Molecular Weight (g/mol) | 198.22 |
| ChEBI | CHEBI:53436 |
| MDL Number | MFCD00008590 |
| SMILES | CC(=C)C(=O)OCCOC(=O)C(C)=C |
| Synonym | ethylene glycol dimethacrylate,ethylene dimethacrylate,glycol dimethacrylate,diglycol dimethacrylate,ethanediol dimethacrylate,ethylenedimethyacrylate,ethylene methacrylate,ethyldiol metacrylate,1,2-bis methacryloyloxy ethane,ethylene glycol bis methacrylate |
| IUPAC Name | 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate |
| InChI Key | STVZJERGLQHEKB-UHFFFAOYSA-N |
| Molecular Formula | C10H14O4 |
Trifluoromethanesulfonyl chloride, 99%
CAS: 421-83-0 Molecular Formula: CClF3O2S Molecular Weight (g/mol): 168.51 MDL Number: MFCD00007451 InChI Key: GRGCWBWNLSTIEN-UHFFFAOYSA-N Synonym: trifluoromethanesulphonyl chloride,triflyl chloride,methanesulfonyl chloride, trifluoro,trifluoromethanesulfonylchloride,trifluoro-methanesulfonyl chloride,methanesulfonylchloride, trifluoro,trifluoromethylsulfonyl chloride,triflic chloride,pfc-msc,cf3so2cl PubChem CID: 79000 IUPAC Name: trifluoromethanesulfonyl chloride SMILES: FC(F)(F)S(Cl)(=O)=O
| PubChem CID | 79000 |
|---|---|
| CAS | 421-83-0 |
| Molecular Weight (g/mol) | 168.51 |
| MDL Number | MFCD00007451 |
| SMILES | FC(F)(F)S(Cl)(=O)=O |
| Synonym | trifluoromethanesulphonyl chloride,triflyl chloride,methanesulfonyl chloride, trifluoro,trifluoromethanesulfonylchloride,trifluoro-methanesulfonyl chloride,methanesulfonylchloride, trifluoro,trifluoromethylsulfonyl chloride,triflic chloride,pfc-msc,cf3so2cl |
| IUPAC Name | trifluoromethanesulfonyl chloride |
| InChI Key | GRGCWBWNLSTIEN-UHFFFAOYSA-N |
| Molecular Formula | CClF3O2S |