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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Neopentyl alcohol, 99%
CAS: 75-84-3 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00004682 InChI Key: KPSSIOMAKSHJJG-UHFFFAOYSA-N Synonym: neopentyl alcohol,2,2-dimethyl-1-propanol,2,2-dimethylpropanol,tert-butylcarbinol,1-propanol, 2,2-dimethyl,tert-butyl carbinol,neopentanol,neopentylalcohol,neoamyl alcohol,2,2-dimethylpropyl alcohol PubChem CID: 6404 IUPAC Name: 2,2-dimethylpropan-1-ol SMILES: CC(C)(C)CO
| PubChem CID | 6404 |
|---|---|
| CAS | 75-84-3 |
| Molecular Weight (g/mol) | 88.15 |
| MDL Number | MFCD00004682 |
| SMILES | CC(C)(C)CO |
| Synonym | neopentyl alcohol,2,2-dimethyl-1-propanol,2,2-dimethylpropanol,tert-butylcarbinol,1-propanol, 2,2-dimethyl,tert-butyl carbinol,neopentanol,neopentylalcohol,neoamyl alcohol,2,2-dimethylpropyl alcohol |
| IUPAC Name | 2,2-dimethylpropan-1-ol |
| InChI Key | KPSSIOMAKSHJJG-UHFFFAOYSA-N |
| Molecular Formula | C5H12O |
Dicyclohexylamine, 98%
CAS: 101-83-7 Molecular Formula: C12H23N Molecular Weight (g/mol): 181.32 MDL Number: MFCD00011658 InChI Key: XBPCUCUWBYBCDP-UHFFFAOYSA-N Synonym: dicyclohexylamine,dcha,dicha,cyclohexanamine, n-cyclohexyl,n,n-dicyclohexylamine,dodecahydrodiphenylamine,dicyklohexylamin,n,n-diclohexylamine,n-cyclohexyl-cyclohexylamine,dicyklohexylamin czech PubChem CID: 7582 ChEBI: CHEBI:34694 IUPAC Name: N-cyclohexylcyclohexanamine SMILES: C1CCC(CC1)NC1CCCCC1
| PubChem CID | 7582 |
|---|---|
| CAS | 101-83-7 |
| Molecular Weight (g/mol) | 181.32 |
| ChEBI | CHEBI:34694 |
| MDL Number | MFCD00011658 |
| SMILES | C1CCC(CC1)NC1CCCCC1 |
| Synonym | dicyclohexylamine,dcha,dicha,cyclohexanamine, n-cyclohexyl,n,n-dicyclohexylamine,dodecahydrodiphenylamine,dicyklohexylamin,n,n-diclohexylamine,n-cyclohexyl-cyclohexylamine,dicyklohexylamin czech |
| IUPAC Name | N-cyclohexylcyclohexanamine |
| InChI Key | XBPCUCUWBYBCDP-UHFFFAOYSA-N |
| Molecular Formula | C12H23N |
4-Nitro-2-(trifluoromethyl)aniline, 98%
CAS: 121-01-7 Molecular Formula: C7H5F3N2O2 Molecular Weight (g/mol): 206.124 MDL Number: MFCD00007365 InChI Key: HOTZLWVITTVZGY-UHFFFAOYSA-N Synonym: 2-amino-5-nitrobenzotrifluoride,4-nitro-2-trifluoromethyl aniline,2-amino-5-nitro-trifluorobenzene,4-nitro-alpha,alpha,alpha-trifluoro-o-toluidine,4-nitro-2-trifluoromethyl benzenamine,4-nitro-a,a,a-trifluoro-o-toluidine,benzenamine, 4-nitro-2-trifluoromethyl,5-nitro-2-aminobenzotrifluoride,2-trifluoromethyl-4-nitroaniline,a,a,a-trifluoro-4-nitro-o-toluidine PubChem CID: 67128 IUPAC Name: 4-nitro-2-(trifluoromethyl)aniline SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)N
| PubChem CID | 67128 |
|---|---|
| CAS | 121-01-7 |
| Molecular Weight (g/mol) | 206.124 |
| MDL Number | MFCD00007365 |
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)N |
| Synonym | 2-amino-5-nitrobenzotrifluoride,4-nitro-2-trifluoromethyl aniline,2-amino-5-nitro-trifluorobenzene,4-nitro-alpha,alpha,alpha-trifluoro-o-toluidine,4-nitro-2-trifluoromethyl benzenamine,4-nitro-a,a,a-trifluoro-o-toluidine,benzenamine, 4-nitro-2-trifluoromethyl,5-nitro-2-aminobenzotrifluoride,2-trifluoromethyl-4-nitroaniline,a,a,a-trifluoro-4-nitro-o-toluidine |
| IUPAC Name | 4-nitro-2-(trifluoromethyl)aniline |
| InChI Key | HOTZLWVITTVZGY-UHFFFAOYSA-N |
| Molecular Formula | C7H5F3N2O2 |
1,4-Diaminobutane, 98+%
CAS: 110-60-1 Molecular Formula: C4H12N2 Molecular Weight (g/mol): 88.154 MDL Number: MFCD00008235 InChI Key: KIDHWZJUCRJVML-UHFFFAOYSA-N Synonym: 1,4-diaminobutane,putrescine,1,4-butanediamine,tetramethylenediamine,butylenediamine,putrescin,1,4-butylenediamine,tetramethyldiamine,1,4-tetramethylenediamine,putrescina PubChem CID: 1045 ChEBI: CHEBI:17148 IUPAC Name: butane-1,4-diamine SMILES: C(CCN)CN
| PubChem CID | 1045 |
|---|---|
| CAS | 110-60-1 |
| Molecular Weight (g/mol) | 88.154 |
| ChEBI | CHEBI:17148 |
| MDL Number | MFCD00008235 |
| SMILES | C(CCN)CN |
| Synonym | 1,4-diaminobutane,putrescine,1,4-butanediamine,tetramethylenediamine,butylenediamine,putrescin,1,4-butylenediamine,tetramethyldiamine,1,4-tetramethylenediamine,putrescina |
| IUPAC Name | butane-1,4-diamine |
| InChI Key | KIDHWZJUCRJVML-UHFFFAOYSA-N |
| Molecular Formula | C4H12N2 |
Ethosuximide 98.0+%, TCI America™
CAS: 77-67-8 Molecular Formula: C7H11NO2 Molecular Weight (g/mol): 141.17 MDL Number: MFCD00072123 InChI Key: HAPOVYFOVVWLRS-UHFFFAOYNA-N Synonym: ethosuximide,zarontin,etosuximida,2-ethyl-2-methylsuccinimide,ethosuxide,ethosuccimide,ethosuccinimide,petnidan,suxinutin,atysmal PubChem CID: 3291 ChEBI: CHEBI:4887 IUPAC Name: 3-ethyl-3-methylpyrrolidine-2,5-dione SMILES: CCC1(C)CC(=O)NC1=O
| PubChem CID | 3291 |
|---|---|
| CAS | 77-67-8 |
| Molecular Weight (g/mol) | 141.17 |
| ChEBI | CHEBI:4887 |
| MDL Number | MFCD00072123 |
| SMILES | CCC1(C)CC(=O)NC1=O |
| Synonym | ethosuximide,zarontin,etosuximida,2-ethyl-2-methylsuccinimide,ethosuxide,ethosuccimide,ethosuccinimide,petnidan,suxinutin,atysmal |
| IUPAC Name | 3-ethyl-3-methylpyrrolidine-2,5-dione |
| InChI Key | HAPOVYFOVVWLRS-UHFFFAOYNA-N |
| Molecular Formula | C7H11NO2 |
Naltrexone hydrochloride, Thermo Scientific Chemicals
CAS: 16676-29-2 Molecular Formula: C20H24ClNO4 Molecular Weight (g/mol): 377.865 MDL Number: MFCD00069324 InChI Key: RHBRMCOKKKZVRY-ITLPAZOVSA-N Synonym: naltrexone hydrochloride,naltrexone hcl,trexan,depade,antaxone,revia,nalorex,unii-z6375yw9sf,nemexin PubChem CID: 5485201 IUPAC Name: (4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride SMILES: C1CC1CN2CCC34C5C(=O)CCC3(C2CC6=C4C(=C(C=C6)O)O5)O.Cl
| PubChem CID | 5485201 |
|---|---|
| CAS | 16676-29-2 |
| Molecular Weight (g/mol) | 377.865 |
| MDL Number | MFCD00069324 |
| SMILES | C1CC1CN2CCC34C5C(=O)CCC3(C2CC6=C4C(=C(C=C6)O)O5)O.Cl |
| Synonym | naltrexone hydrochloride,naltrexone hcl,trexan,depade,antaxone,revia,nalorex,unii-z6375yw9sf,nemexin |
| IUPAC Name | (4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride |
| InChI Key | RHBRMCOKKKZVRY-ITLPAZOVSA-N |
| Molecular Formula | C20H24ClNO4 |
Graphite flake, median 7-10 micron, 99%, Thermo Scientific Chemicals
CAS: 7782-42-5 Molecular Formula: C Molecular Weight (g/mol): 12.01 MDL Number: MFCD00133992 MFCD00144065 MFCD00146977 MFCD00211867 MFCD06411993 MFCD07370731 InChI Key: OKTJSMMVPCPJKN-UHFFFAOYSA-N IUPAC Name: carbon SMILES: [C]
| CAS | 7782-42-5 |
|---|---|
| Molecular Weight (g/mol) | 12.01 |
| MDL Number | MFCD00133992 MFCD00144065 MFCD00146977 MFCD00211867 MFCD06411993 MFCD07370731 |
| SMILES | [C] |
| IUPAC Name | carbon |
| InChI Key | OKTJSMMVPCPJKN-UHFFFAOYSA-N |
| Molecular Formula | C |
Methoxyacetonitrile, 98%
CAS: 1738-36-9 Molecular Formula: C3H5NO Molecular Weight (g/mol): 71.08 MDL Number: MFCD00001892 InChI Key: QKPVEISEHYYHRH-UHFFFAOYSA-N PubChem CID: 74442 IUPAC Name: 2-methoxyacetonitrile SMILES: COCC#N
| PubChem CID | 74442 |
|---|---|
| CAS | 1738-36-9 |
| Molecular Weight (g/mol) | 71.08 |
| MDL Number | MFCD00001892 |
| SMILES | COCC#N |
| IUPAC Name | 2-methoxyacetonitrile |
| InChI Key | QKPVEISEHYYHRH-UHFFFAOYSA-N |
| Molecular Formula | C3H5NO |
Methyl thioglycolate, 98%
CAS: 2365-48-2 Molecular Formula: C3H6O2S Molecular Weight (g/mol): 106.14 MDL Number: MFCD00004873 InChI Key: MKIJJIMOAABWGF-UHFFFAOYSA-N Synonym: methyl thioglycolate,methyl mercaptoacetate,methyl 2-mercaptoacetate,methylthioglycolate,thioglycolic acid methyl ester,acetic acid, mercapto-, methyl ester,methanethiol, methoxy,usaf ek-7119,thioglykolsaeure-methylester,unii-o1608la9el PubChem CID: 16907 IUPAC Name: methyl 2-sulfanylacetate SMILES: COC(=O)CS
| PubChem CID | 16907 |
|---|---|
| CAS | 2365-48-2 |
| Molecular Weight (g/mol) | 106.14 |
| MDL Number | MFCD00004873 |
| SMILES | COC(=O)CS |
| Synonym | methyl thioglycolate,methyl mercaptoacetate,methyl 2-mercaptoacetate,methylthioglycolate,thioglycolic acid methyl ester,acetic acid, mercapto-, methyl ester,methanethiol, methoxy,usaf ek-7119,thioglykolsaeure-methylester,unii-o1608la9el |
| IUPAC Name | methyl 2-sulfanylacetate |
| InChI Key | MKIJJIMOAABWGF-UHFFFAOYSA-N |
| Molecular Formula | C3H6O2S |
1,4-Diethoxybenzene, 98%
CAS: 122-95-2 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00015146 InChI Key: VWGNFIQXBYRDCH-UHFFFAOYSA-N Synonym: benzene, 1,4-diethoxy,p-diethoxybenzene,hydroquinone diethyl ether,benzene, p-diethoxy,diethoxybenzene,1,4-diethoxy-benzen,benzene,4-diethoxy,1,4-diethoxybenzol,hydroquinonedlethylether,acmc-209ans PubChem CID: 67150 IUPAC Name: 1,4-diethoxybenzene SMILES: CCOC1=CC=C(OCC)C=C1
| PubChem CID | 67150 |
|---|---|
| CAS | 122-95-2 |
| Molecular Weight (g/mol) | 166.22 |
| MDL Number | MFCD00015146 |
| SMILES | CCOC1=CC=C(OCC)C=C1 |
| Synonym | benzene, 1,4-diethoxy,p-diethoxybenzene,hydroquinone diethyl ether,benzene, p-diethoxy,diethoxybenzene,1,4-diethoxy-benzen,benzene,4-diethoxy,1,4-diethoxybenzol,hydroquinonedlethylether,acmc-209ans |
| IUPAC Name | 1,4-diethoxybenzene |
| InChI Key | VWGNFIQXBYRDCH-UHFFFAOYSA-N |
| Molecular Formula | C10H14O2 |
Thermo Scientific Chemicals (±)-Verapamil hydrochloride, 99+%
CAS: 152-11-4 Molecular Formula: C27H38N2O4·HCl Molecular Weight (g/mol): 491.07 MDL Number: MFCD00055208 InChI Key: DOQPXTMNIUCOSY-UHFFFAOYSA-N Synonym: verapamil hydrochloride,verapamil hcl,manidon,calcan hydrochloride,cardibeltin,cardiabeltin,cardioprotect,veroptinstada,calaptin,caveril PubChem CID: 62969 IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile;hydrochloride SMILES: CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC.Cl
| PubChem CID | 62969 |
|---|---|
| CAS | 152-11-4 |
| Molecular Weight (g/mol) | 491.07 |
| MDL Number | MFCD00055208 |
| SMILES | CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC.Cl |
| Synonym | verapamil hydrochloride,verapamil hcl,manidon,calcan hydrochloride,cardibeltin,cardiabeltin,cardioprotect,veroptinstada,calaptin,caveril |
| IUPAC Name | 2-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile;hydrochloride |
| InChI Key | DOQPXTMNIUCOSY-UHFFFAOYSA-N |
| Molecular Formula | C27H38N2O4·HCl |
4,4,5,5-Tetramethyl-1,3,2-dioxaborolane 97.0+%, TCI America™
CAS: 25015-63-8 Molecular Formula: C6H13BO2 Molecular Weight (g/mol): 127.98 MDL Number: MFCD00674030 InChI Key: UCFSYHMCKWNKAH-UHFFFAOYSA-N Synonym: pinacolborane,4,4,5,5-tetramethyl-1,3,2-dioxaborolane,1,3,2-dioxaborolane, 4,4,5,5-tetramethyl,4,4,5,5-tetramethyl-1,3,2-dioxa-borolane,pinb-te,pubchem12688,acmc-209ggf,pinacolborane 5g,ksc489k6t,ucfsyhmckwnkah-uhfffaoysa-n PubChem CID: 6364989 IUPAC Name: 4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: CC1(C)OBOC1(C)C
| PubChem CID | 6364989 |
|---|---|
| CAS | 25015-63-8 |
| Molecular Weight (g/mol) | 127.98 |
| MDL Number | MFCD00674030 |
| SMILES | CC1(C)OBOC1(C)C |
| Synonym | pinacolborane,4,4,5,5-tetramethyl-1,3,2-dioxaborolane,1,3,2-dioxaborolane, 4,4,5,5-tetramethyl,4,4,5,5-tetramethyl-1,3,2-dioxa-borolane,pinb-te,pubchem12688,acmc-209ggf,pinacolborane 5g,ksc489k6t,ucfsyhmckwnkah-uhfffaoysa-n |
| IUPAC Name | 4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI Key | UCFSYHMCKWNKAH-UHFFFAOYSA-N |
| Molecular Formula | C6H13BO2 |
4,4'-Difluorobiphenyl, 99%
CAS: 398-23-2 Molecular Formula: C12H8F2 Molecular Weight (g/mol): 190.193 MDL Number: MFCD00000349 InChI Key: PZDAAZQDQJGXSW-UHFFFAOYSA-N Synonym: 4,4'-difluorobiphenyl,4,4'-difluoro-1,1'-biphenyl,4,4'-difluorodiphenyl,1-fluoro-4-4-fluorophenyl benzene,unii-o0694gmk81,1,1'-biphenyl, 4,4'-difluoro,4-fluoro-1-4-fluorophenyl benzene,pubchem2016,4,4'-difluorobipheny,biphenyl,4'-difluoro PubChem CID: 9811 IUPAC Name: 1-fluoro-4-(4-fluorophenyl)benzene SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)F)F
| PubChem CID | 9811 |
|---|---|
| CAS | 398-23-2 |
| Molecular Weight (g/mol) | 190.193 |
| MDL Number | MFCD00000349 |
| SMILES | C1=CC(=CC=C1C2=CC=C(C=C2)F)F |
| Synonym | 4,4'-difluorobiphenyl,4,4'-difluoro-1,1'-biphenyl,4,4'-difluorodiphenyl,1-fluoro-4-4-fluorophenyl benzene,unii-o0694gmk81,1,1'-biphenyl, 4,4'-difluoro,4-fluoro-1-4-fluorophenyl benzene,pubchem2016,4,4'-difluorobipheny,biphenyl,4'-difluoro |
| IUPAC Name | 1-fluoro-4-(4-fluorophenyl)benzene |
| InChI Key | PZDAAZQDQJGXSW-UHFFFAOYSA-N |
| Molecular Formula | C12H8F2 |
Poly(vinyl alcohol), 98.0-98.8% hydrolyzed, M.W. approx. 31,000-50,000
CAS: 9002-89-5 Molecular Formula: (C2H4O)n Molecular Weight (g/mol): 44.05 MDL Number: MFCD00081922 InChI Key: IMROMDMJAWUWLK-UHFFFAOYSA-N Synonym: vinyl alcohol,polyvinyl alcohol,hydroxyethene,hydroxyethylene,ethenol, homopolymer,gohsenol,polyviol,elvanol,mowiol,poval PubChem CID: 11199 IUPAC Name: ethenol SMILES: OC(-*)C-*
| PubChem CID | 11199 |
|---|---|
| CAS | 9002-89-5 |
| Molecular Weight (g/mol) | 44.05 |
| MDL Number | MFCD00081922 |
| SMILES | OC(-*)C-* |
| Synonym | vinyl alcohol,polyvinyl alcohol,hydroxyethene,hydroxyethylene,ethenol, homopolymer,gohsenol,polyviol,elvanol,mowiol,poval |
| IUPAC Name | ethenol |
| InChI Key | IMROMDMJAWUWLK-UHFFFAOYSA-N |
| Molecular Formula | (C2H4O)n |
3-(Trimethylsilyl)propionic acid-d4 sodium salt, 98 atom% D
CAS: 24493-21-8 Molecular Formula: C6H9D4NaO2Si Molecular Weight (g/mol): 172.27 InChI Key: OIIWPAYIXDCDNL-HGFPCDIYSA-M Synonym: sodium 3-trimethylsilyl 2,2,3,3-2h4 propionate,3-trimethylsilyl propionic acid-d4 sodium salt,2,2,3,3-d4-3-trimethylsilyl propionic acid sodium salt,sodium 3-trimethylsilyl 2 h? propanoate,sodium 3-trimethylsilyl 2h4 propanoate,tsp-d4,propanoic-2,2,3,3-d4 acid, 3-trimethylsilyl-, sodium salt,sodium 3-trimethylsilyl propionate-2,2,3,3-d4,3-trimethylsilyl propionic-2,2,3,3-d4 acid sodium salt,sodium-3-trimethylsilyl-2,2,3,3-tetradeuteriopropionate PubChem CID: 23688921 IUPAC Name: sodium;2,2,3,3-tetradeuterio-3-trimethylsilylpropanoate SMILES: C[Si](C)(C)CCC(=O)[O-].[Na+]
| PubChem CID | 23688921 |
|---|---|
| CAS | 24493-21-8 |
| Molecular Weight (g/mol) | 172.27 |
| SMILES | C[Si](C)(C)CCC(=O)[O-].[Na+] |
| Synonym | sodium 3-trimethylsilyl 2,2,3,3-2h4 propionate,3-trimethylsilyl propionic acid-d4 sodium salt,2,2,3,3-d4-3-trimethylsilyl propionic acid sodium salt,sodium 3-trimethylsilyl 2 h? propanoate,sodium 3-trimethylsilyl 2h4 propanoate,tsp-d4,propanoic-2,2,3,3-d4 acid, 3-trimethylsilyl-, sodium salt,sodium 3-trimethylsilyl propionate-2,2,3,3-d4,3-trimethylsilyl propionic-2,2,3,3-d4 acid sodium salt,sodium-3-trimethylsilyl-2,2,3,3-tetradeuteriopropionate |
| IUPAC Name | sodium;2,2,3,3-tetradeuterio-3-trimethylsilylpropanoate |
| InChI Key | OIIWPAYIXDCDNL-HGFPCDIYSA-M |
| Molecular Formula | C6H9D4NaO2Si |