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.
Filtered Search Results
n-Decane, MP Biomedicals™
CAS: 124-18-5 Molecular Formula: C10H22 Molecular Weight (g/mol): 142.29 InChI Key: DIOQZVSQGTUSAI-UHFFFAOYSA-N Synonym: n-decane,nonane, methyl,decyl hydride,unii-nk85062oiy,ccris 653,hsdb 63,dsstox_cid_4913,decane, analytical standard,dsstox_rid_77577,dsstox_gsid_24913 PubChem CID: 15600 ChEBI: CHEBI:41808 IUPAC Name: decane SMILES: CCCCCCCCCC
| PubChem CID | 15600 |
|---|---|
| CAS | 124-18-5 |
| Molecular Weight (g/mol) | 142.29 |
| ChEBI | CHEBI:41808 |
| SMILES | CCCCCCCCCC |
| Synonym | n-decane,nonane, methyl,decyl hydride,unii-nk85062oiy,ccris 653,hsdb 63,dsstox_cid_4913,decane, analytical standard,dsstox_rid_77577,dsstox_gsid_24913 |
| IUPAC Name | decane |
| InChI Key | DIOQZVSQGTUSAI-UHFFFAOYSA-N |
| Molecular Formula | C10H22 |
n-Undecane, 99.7%, MP Biomedicals™
CAS: 1120-21-4 Molecular Formula: C11H24 Molecular Weight (g/mol): 156.31 MDL Number: MFCD00008959 InChI Key: RSJKGSCJYJTIGS-UHFFFAOYSA-N Synonym: n-undecane,hendecane,n-hendecane,decane, methyl,unii-jv0qt00nue,ccris 3796,jv0qt00nue,undecane,undecane, analytical standard,und PubChem CID: 14257 ChEBI: CHEBI:46342 IUPAC Name: undecane SMILES: CCCCCCCCCCC
| PubChem CID | 14257 |
|---|---|
| CAS | 1120-21-4 |
| Molecular Weight (g/mol) | 156.31 |
| ChEBI | CHEBI:46342 |
| MDL Number | MFCD00008959 |
| SMILES | CCCCCCCCCCC |
| Synonym | n-undecane,hendecane,n-hendecane,decane, methyl,unii-jv0qt00nue,ccris 3796,jv0qt00nue,undecane,undecane, analytical standard,und |
| IUPAC Name | undecane |
| InChI Key | RSJKGSCJYJTIGS-UHFFFAOYSA-N |
| Molecular Formula | C11H24 |
Poly(vinyl alcohol), 87.0-89.0% 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 |
Sodium 1-pentanesulfonate monohydrate, HPLC grade
CAS: 207605-40-1 Molecular Formula: C5H13NaO4S Molecular Weight (g/mol): 192.205 MDL Number: MFCD00007541 InChI Key: FPQYXAFKHLSWTI-UHFFFAOYSA-M Synonym: sodium pentane-1-sulfonate hydrate,1-pentanesulfonic acid sodium salt monohydrate,sodium 1-pentanesulfonate monohydrate,potassium hydrate pentane-1-sulfonate,sodium 1-pentanesulfonate hydrate,sodium hydrate pentane-1-sulfonate,sodium pentane-1-sulfonate-water 1/1/1,1-pentane sulphonic acid sodium salt monohydrate,1-pentanesulfonic acid sodium salt monohydydrate,sodium 1-pentanesulfonate monohydrate, hplc grade PubChem CID: 23693099 IUPAC Name: sodium;pentane-1-sulfonate;hydrate SMILES: CCCCCS(=O)(=O)[O-].O.[Na+]
| PubChem CID | 23693099 |
|---|---|
| CAS | 207605-40-1 |
| Molecular Weight (g/mol) | 192.205 |
| MDL Number | MFCD00007541 |
| SMILES | CCCCCS(=O)(=O)[O-].O.[Na+] |
| Synonym | sodium pentane-1-sulfonate hydrate,1-pentanesulfonic acid sodium salt monohydrate,sodium 1-pentanesulfonate monohydrate,potassium hydrate pentane-1-sulfonate,sodium 1-pentanesulfonate hydrate,sodium hydrate pentane-1-sulfonate,sodium pentane-1-sulfonate-water 1/1/1,1-pentane sulphonic acid sodium salt monohydrate,1-pentanesulfonic acid sodium salt monohydydrate,sodium 1-pentanesulfonate monohydrate, hplc grade |
| IUPAC Name | sodium;pentane-1-sulfonate;hydrate |
| InChI Key | FPQYXAFKHLSWTI-UHFFFAOYSA-M |
| Molecular Formula | C5H13NaO4S |
Trimethylsilyl trifluoromethanesulfonate, 99%
CAS: 27607-77-8 Molecular Formula: C4H9F3O3SSi Molecular Weight (g/mol): 222.26 MDL Number: MFCD00000406 InChI Key: FTVLMFQEYACZNP-UHFFFAOYSA-N Synonym: trimethylsilyl triflate,tmsotf,trifluoromethanesulfonic acid trimethylsilyl ester,trimethylsilyl trifluoromethylsulphonate,unii-z84v0cbh9j,methanesulfonic acid, trifluoro-, trimethylsilyl ester,trimethylsilyl trifluoromethylsulfonate,trimethylsllytrifluoromethanesulphonate,trimethylsilyl trifluoromethanesulphonate,trimethylsilyltrifluoromethanesulphonate PubChem CID: 65367 IUPAC Name: trimethylsilyl trifluoromethanesulfonate SMILES: C[Si](C)(C)OS(=O)(=O)C(F)(F)F
| PubChem CID | 65367 |
|---|---|
| CAS | 27607-77-8 |
| Molecular Weight (g/mol) | 222.26 |
| MDL Number | MFCD00000406 |
| SMILES | C[Si](C)(C)OS(=O)(=O)C(F)(F)F |
| Synonym | trimethylsilyl triflate,tmsotf,trifluoromethanesulfonic acid trimethylsilyl ester,trimethylsilyl trifluoromethylsulphonate,unii-z84v0cbh9j,methanesulfonic acid, trifluoro-, trimethylsilyl ester,trimethylsilyl trifluoromethylsulfonate,trimethylsllytrifluoromethanesulphonate,trimethylsilyl trifluoromethanesulphonate,trimethylsilyltrifluoromethanesulphonate |
| IUPAC Name | trimethylsilyl trifluoromethanesulfonate |
| InChI Key | FTVLMFQEYACZNP-UHFFFAOYSA-N |
| Molecular Formula | C4H9F3O3SSi |
Lecithin, 90%, soybean
CAS: 8002-43-5 Molecular Formula: C42H80NO8P Molecular Weight (g/mol): 758.075 MDL Number: MFCD00147406 InChI Key: JLPULHDHAOZNQI-JLOPVYAASA-N Synonym: 3-sn-phosphatidylcholine,1-hexadecanoyl-2-9e,12e-octadecadienoyl-sn-glycero-3-phosphocholine,1,2-diacyl-sn-glycero-3-phosphocholine,3,5,8-trioxa-4-phosphahexacosa-17,20-dien-1-aminium, 4-hydroxy-n,n,n-trimethyl-9-oxo-7-1-oxohexadecyl oxy methyl-, inner salt, 4-oxide, r,l-,a-lecithin,2-linoleoyl-1-palmitoyl-sn-glycero-3-phosphocholine,a-phosphatidylcholine solution,l-alpha-phosphatidylcholine solution,2-linoleoyl-1-palmitoyl-sn-glyc-ero-3-phosphocholine PubChem CID: 16213884 ChEBI: CHEBI:86658 IUPAC Name: [(2R)-3-hexadecanoyloxy-2-[(9E,12E)-octadeca-9,12-dienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate SMILES: CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCC=CCCCCC
| PubChem CID | 16213884 |
|---|---|
| CAS | 8002-43-5 |
| Molecular Weight (g/mol) | 758.075 |
| ChEBI | CHEBI:86658 |
| MDL Number | MFCD00147406 |
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCC=CCCCCC |
| Synonym | 3-sn-phosphatidylcholine,1-hexadecanoyl-2-9e,12e-octadecadienoyl-sn-glycero-3-phosphocholine,1,2-diacyl-sn-glycero-3-phosphocholine,3,5,8-trioxa-4-phosphahexacosa-17,20-dien-1-aminium, 4-hydroxy-n,n,n-trimethyl-9-oxo-7-1-oxohexadecyl oxy methyl-, inner salt, 4-oxide, r,l-,a-lecithin,2-linoleoyl-1-palmitoyl-sn-glycero-3-phosphocholine,a-phosphatidylcholine solution,l-alpha-phosphatidylcholine solution,2-linoleoyl-1-palmitoyl-sn-glyc-ero-3-phosphocholine |
| IUPAC Name | [(2R)-3-hexadecanoyloxy-2-[(9E,12E)-octadeca-9,12-dienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate |
| InChI Key | JLPULHDHAOZNQI-JLOPVYAASA-N |
| Molecular Formula | C42H80NO8P |
| Viscosity | 3.13 mPa.s (19°C) |
|---|---|
| Linear Formula | (CH3)4NOH |
| Molecular Weight (g/mol) | 91.15 |
| InChI Key | WGTYBPLFGIVFAS-UHFFFAOYSA-M |
| Density | 1.0140g/mL |
| PubChem CID | 60966 |
| Name Note | 25% in Water |
| Percent Purity | 23 to 27% |
| Fieser | 11,514 |
| RTECS Number | PA0875000 |
| Formula Weight | 91.15 |
| Melting Point | -25.0°C |
| Boiling Point | 102.0°C |
| Color | Colorless to Yellow |
| Physical Form | Solution |
| Chemical Name or Material | Tetramethylammonium hydroxide |
| SMILES | C[N+](C)(C)C.[OH-] |
| Merck Index | 15,9371 |
| CAS | 7732-18-5 |
| Health Hazard 3 | GHS P Statement Wear protective gloves/protective clothing/eye protection/face protection. IF SWALLOWED: rinse mouth. Do NOT induce vomiting. Rinse mouth. IF IN EYES: Rinse cautiously with water for several minutes. Remove con |
| MDL Number | MFCD00008280 |
| Health Hazard 2 | GHS H Statement Causes severe skin burns and eye damage. Toxic if swallowed. Fatal in contact with skin. Causes damage to organs. Causes damage to organs through prolonged or repeated exposure. Toxic to aquatic life w |
| Solubility Information | Solubility in water: soluble. |
| Packaging | Plastic bottle |
| Flash Point | >95°C |
| Health Hazard 1 | GHS Signal Word: Danger |
| Refractive Index | 1.3780 to 1.3840 (20°C, 589nm) |
| Synonym | tetramethylammonium hydroxide,tmah,hydroxyde de tetramethylammonium,nmw-w,nmd 3,tetramethyl ammonium hydroxide,unii-5gkp7317q2,ammonium, tetramethyl-, hydroxide,methanaminium, n,n,n-trimethyl-, hydroxide,tetramethylammoniumhydroxide |
| TSCA | TSCA |
| IUPAC Name | tetramethylazanium;hydroxide |
| Beilstein | 04,5 |
| Molecular Formula | C4H13NO |
| EINECS Number | 200-882-9 |
| Specific Gravity | 1.014 |
o-Tolidine dihydrochloride, ACS
CAS: 612-82-8 Molecular Formula: C14H18Cl2N2 Molecular Weight (g/mol): 285.212 MDL Number: MFCD00012960 InChI Key: LUKPNZHXJRJBAN-UHFFFAOYSA-N Synonym: 3,3'-dimethylbenzidine dihydrochloride,o-tolidine dihydrochloride,3,3'-dimethyl-1,1'-biphenyl-4,4'-diamine dihydrochloride,unii-5msk350kd8,dsstox_cid_511,dsstox_rid_75633,dsstox_gsid_20511,tolidine dihydrochloride,1,1'-biphenyl-4,4'-diamine, 3,3'-dimethyl-, dihydrochloride,3,3'-dimethylbenzidine.2hcl PubChem CID: 108938 IUPAC Name: 4-(4-amino-3-methylphenyl)-2-methylaniline;dihydrochloride SMILES: CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N.Cl.Cl
| PubChem CID | 108938 |
|---|---|
| CAS | 612-82-8 |
| Molecular Weight (g/mol) | 285.212 |
| MDL Number | MFCD00012960 |
| SMILES | CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N.Cl.Cl |
| Synonym | 3,3'-dimethylbenzidine dihydrochloride,o-tolidine dihydrochloride,3,3'-dimethyl-1,1'-biphenyl-4,4'-diamine dihydrochloride,unii-5msk350kd8,dsstox_cid_511,dsstox_rid_75633,dsstox_gsid_20511,tolidine dihydrochloride,1,1'-biphenyl-4,4'-diamine, 3,3'-dimethyl-, dihydrochloride,3,3'-dimethylbenzidine.2hcl |
| IUPAC Name | 4-(4-amino-3-methylphenyl)-2-methylaniline;dihydrochloride |
| InChI Key | LUKPNZHXJRJBAN-UHFFFAOYSA-N |
| Molecular Formula | C14H18Cl2N2 |
2-Furaldehyde, 99%
CAS: 98-01-1 Molecular Formula: C5H4O2 Molecular Weight (g/mol): 96.09 MDL Number: MFCD00003229 InChI Key: HYBBIBNJHNGZAN-UHFFFAOYSA-N Synonym: furfural,2-furaldehyde,2-furancarboxaldehyde,furaldehyde,2-formylfuran,furfuraldehyde,fural,2-furanaldehyde,2-furancarbonal,2-furfural PubChem CID: 7362 ChEBI: CHEBI:34768 IUPAC Name: furan-2-carbaldehyde SMILES: O=CC1=CC=CO1
| PubChem CID | 7362 |
|---|---|
| CAS | 98-01-1 |
| Molecular Weight (g/mol) | 96.09 |
| ChEBI | CHEBI:34768 |
| MDL Number | MFCD00003229 |
| SMILES | O=CC1=CC=CO1 |
| Synonym | furfural,2-furaldehyde,2-furancarboxaldehyde,furaldehyde,2-formylfuran,furfuraldehyde,fural,2-furanaldehyde,2-furancarbonal,2-furfural |
| IUPAC Name | furan-2-carbaldehyde |
| InChI Key | HYBBIBNJHNGZAN-UHFFFAOYSA-N |
| Molecular Formula | C5H4O2 |
2,2,6,6-Tetramethylpiperidinooxy, 98%
CAS: 2564-83-2 Molecular Formula: C9H18NO Molecular Weight (g/mol): 156.25 MDL Number: MFCD00009599 InChI Key: QYTDEUPAUMOIOP-UHFFFAOYSA-N Synonym: TEMPO IUPAC Name: (2,2,6,6-tetramethylpiperidin-1-yl)oxidanyl SMILES: CC1(C)CCCC(C)(C)N1[O]
| CAS | 2564-83-2 |
|---|---|
| Molecular Weight (g/mol) | 156.25 |
| MDL Number | MFCD00009599 |
| SMILES | CC1(C)CCCC(C)(C)N1[O] |
| Synonym | TEMPO |
| IUPAC Name | (2,2,6,6-tetramethylpiperidin-1-yl)oxidanyl |
| InChI Key | QYTDEUPAUMOIOP-UHFFFAOYSA-N |
| Molecular Formula | C9H18NO |
2-Hydroxyisobutyric acid, 99% (dry wt.), water <2%
CAS: 594-61-6 Molecular Formula: C4H8O3 Molecular Weight (g/mol): 104.11 MDL Number: MFCD00004459 InChI Key: BWLBGMIXKSTLSX-UHFFFAOYSA-N Synonym: 2-hydroxyisobutyric acid,2-methyllactic acid,acetonic acid,2-hydroxy-2-methylpropionic acid,alpha-hydroxyisobutyric acid,hydroxydimethylacetic acid,acetonate,propanoic acid, 2-hydroxy-2-methyl,alpha-hydroxyisobutanoic acid,2-hydroxyisobutyricacid PubChem CID: 11671 ChEBI: CHEBI:50129 IUPAC Name: 2-hydroxy-2-methylpropanoic acid SMILES: CC(C)(O)C(O)=O
| PubChem CID | 11671 |
|---|---|
| CAS | 594-61-6 |
| Molecular Weight (g/mol) | 104.11 |
| ChEBI | CHEBI:50129 |
| MDL Number | MFCD00004459 |
| SMILES | CC(C)(O)C(O)=O |
| Synonym | 2-hydroxyisobutyric acid,2-methyllactic acid,acetonic acid,2-hydroxy-2-methylpropionic acid,alpha-hydroxyisobutyric acid,hydroxydimethylacetic acid,acetonate,propanoic acid, 2-hydroxy-2-methyl,alpha-hydroxyisobutanoic acid,2-hydroxyisobutyricacid |
| IUPAC Name | 2-hydroxy-2-methylpropanoic acid |
| InChI Key | BWLBGMIXKSTLSX-UHFFFAOYSA-N |
| Molecular Formula | C4H8O3 |
Brucine sulfate heptahydrate, 98+%, ACS reagent
CAS: 60583-39-3 Molecular Formula: C46H68N4O19S Molecular Weight (g/mol): 1013.12 MDL Number: MFCD00150159 InChI Key: PPJIVFYMRNHHTJ-UMRIXEKQSA-N Synonym: brucinesulfateheptahydrate fornitrateanalysis PubChem CID: 126969999 IUPAC Name: (4aR,5aR,8aR,13aR,15aS,15bR)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinoline-14-one;sulfuric acid;heptahydrate SMILES: O.O.O.O.O.O.O.OS(O)(=O)=O.COC1=CC2=C(C=C1OC)C13CCN4CC5=CCO[C@H]6CC(=O)N2[C@H]1[C@H]6[C@H]5C[C@@H]34.COC1=CC2=C(C=C1OC)C13CCN4CC5=CCO[C@H]6CC(=O)N2[C@H]1[C@H]6[C@H]5C[C@@H]34
| PubChem CID | 126969999 |
|---|---|
| CAS | 60583-39-3 |
| Molecular Weight (g/mol) | 1013.12 |
| MDL Number | MFCD00150159 |
| SMILES | O.O.O.O.O.O.O.OS(O)(=O)=O.COC1=CC2=C(C=C1OC)C13CCN4CC5=CCO[C@H]6CC(=O)N2[C@H]1[C@H]6[C@H]5C[C@@H]34.COC1=CC2=C(C=C1OC)C13CCN4CC5=CCO[C@H]6CC(=O)N2[C@H]1[C@H]6[C@H]5C[C@@H]34 |
| Synonym | brucinesulfateheptahydrate fornitrateanalysis |
| IUPAC Name | (4aR,5aR,8aR,13aR,15aS,15bR)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinoline-14-one;sulfuric acid;heptahydrate |
| InChI Key | PPJIVFYMRNHHTJ-UMRIXEKQSA-N |
| Molecular Formula | C46H68N4O19S |
Diacetyl 98.0+%, TCI America™
CAS: 431-03-8 Molecular Formula: C4H6O2 Molecular Weight (g/mol): 86.09 MDL Number: MFCD00008756 InChI Key: QSJXEFYPDANLFS-UHFFFAOYSA-N Synonym: 2,3-butanedione,diacetyl,biacetyl,dimethylglyoxal,2,3-diketobutane,dimethyl glyoxal,butanedione,dimethyl diketone,2,3-butadione,2,3-dioxobutane PubChem CID: 650 ChEBI: CHEBI:16583 IUPAC Name: butane-2,3-dione SMILES: CC(=O)C(=O)C
| PubChem CID | 650 |
|---|---|
| CAS | 431-03-8 |
| Molecular Weight (g/mol) | 86.09 |
| ChEBI | CHEBI:16583 |
| MDL Number | MFCD00008756 |
| SMILES | CC(=O)C(=O)C |
| Synonym | 2,3-butanedione,diacetyl,biacetyl,dimethylglyoxal,2,3-diketobutane,dimethyl glyoxal,butanedione,dimethyl diketone,2,3-butadione,2,3-dioxobutane |
| IUPAC Name | butane-2,3-dione |
| InChI Key | QSJXEFYPDANLFS-UHFFFAOYSA-N |
| Molecular Formula | C4H6O2 |
N,N-Dimethylaniline, 99%
CAS: 121-69-7 Molecular Formula: C8H11N Molecular Weight (g/mol): 121.18 MDL Number: MFCD00008304 InChI Key: JLTDJTHDQAWBAV-UHFFFAOYSA-N Synonym: dimethylaniline,dimethylphenylamine,n,n-dimethylbenzenamine,benzenamine, n,n-dimethyl,dimethylamino benzene,n,n-dimethylphenylamine,n,n-dimethylbenzeneamine,dimethylaminobenzene,dwumetyloanilina,n,n-dimethylamino benzene PubChem CID: 949 ChEBI: CHEBI:16269 IUPAC Name: N,N-dimethylaniline SMILES: CN(C)C1=CC=CC=C1
| PubChem CID | 949 |
|---|---|
| CAS | 121-69-7 |
| Molecular Weight (g/mol) | 121.18 |
| ChEBI | CHEBI:16269 |
| MDL Number | MFCD00008304 |
| SMILES | CN(C)C1=CC=CC=C1 |
| Synonym | dimethylaniline,dimethylphenylamine,n,n-dimethylbenzenamine,benzenamine, n,n-dimethyl,dimethylamino benzene,n,n-dimethylphenylamine,n,n-dimethylbenzeneamine,dimethylaminobenzene,dwumetyloanilina,n,n-dimethylamino benzene |
| IUPAC Name | N,N-dimethylaniline |
| InChI Key | JLTDJTHDQAWBAV-UHFFFAOYSA-N |
| Molecular Formula | C8H11N |
Benzonitrile, 99%, pure
CAS: 100-47-0 MDL Number: MFCD00001770 InChI Key: JFDZBHWFFUWGJE-UHFFFAOYSA-N Synonym: phenyl cyanide,cyanobenzene,benzenenitrile,benzoic acid nitrile,benzene, cyano,benzenecarbonitrile,phenylcyanide,fenylkyanid,fenylkyanid czech,benzonitril PubChem CID: 7505 ChEBI: CHEBI:27991 IUPAC Name: benzonitrile SMILES: C1=CC=C(C=C1)C#N
| PubChem CID | 7505 |
|---|---|
| CAS | 100-47-0 |
| ChEBI | CHEBI:27991 |
| MDL Number | MFCD00001770 |
| SMILES | C1=CC=C(C=C1)C#N |
| Synonym | phenyl cyanide,cyanobenzene,benzenenitrile,benzoic acid nitrile,benzene, cyano,benzenecarbonitrile,phenylcyanide,fenylkyanid,fenylkyanid czech,benzonitril |
| IUPAC Name | benzonitrile |
| InChI Key | JFDZBHWFFUWGJE-UHFFFAOYSA-N |