Benzenoids
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3,4,5-Trifluorobenzyl Bromide 97.0+%, TCI America™
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CAS: 220141-72-0 Molecular Formula: C7H4BrF3 Molecular Weight (g/mol): 225.01 MDL Number: MFCD00083528 InChI Key: MPEKZIYOLQCWLL-UHFFFAOYSA-N Synonym: 3,4,5-trifluorobenzyl bromide,5-bromomethyl-1,2,3-trifluorobenzene,3,4,5-trifluorobenzylbromide,alpha-bromo-3,4,5-trifluorotoluene,3,4,5-trifluoro benzyl bromide,benzene, 5-bromomethyl-1,2,3-trifluoro,a-bromo-3,4,5-trifluorotoluene,pubchem4670,acmc-1cupe PubChem CID: 2777062 IUPAC Name: 5-(bromomethyl)-1,2,3-trifluorobenzene SMILES: FC1=CC(CBr)=CC(F)=C1F
| PubChem CID | 2777062 |
|---|---|
| CAS | 220141-72-0 |
| Molecular Weight (g/mol) | 225.01 |
| MDL Number | MFCD00083528 |
| SMILES | FC1=CC(CBr)=CC(F)=C1F |
| Synonym | 3,4,5-trifluorobenzyl bromide,5-bromomethyl-1,2,3-trifluorobenzene,3,4,5-trifluorobenzylbromide,alpha-bromo-3,4,5-trifluorotoluene,3,4,5-trifluoro benzyl bromide,benzene, 5-bromomethyl-1,2,3-trifluoro,a-bromo-3,4,5-trifluorotoluene,pubchem4670,acmc-1cupe |
| IUPAC Name | 5-(bromomethyl)-1,2,3-trifluorobenzene |
| InChI Key | MPEKZIYOLQCWLL-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrF3 |
(R)-(-)-alpha-Methoxyphenylacetic Acid 98.0+%, TCI America™
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CAS: 3966-32-3 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00004250 InChI Key: DIWVBIXQCNRCFE-MRVPVSSYSA-N Synonym: r---alpha-methoxyphenylacetic acid,r-2-methoxy-2-phenylacetic acid,2r-2-methoxy-2-phenylacetic acid,r-methoxyphenylacetic acid,r-methoxy phenyl acetic acid,methoxy phenyl acetic acid #,r---.alpha.-methoxyphenylacetic acid,benzeneacetic acid, .alpha.-methoxy-, r,o-methyl-d-mandelic acid,ksc496q9j PubChem CID: 2724294 IUPAC Name: (2R)-2-methoxy-2-phenylacetic acid SMILES: COC(C1=CC=CC=C1)C(=O)O
| PubChem CID | 2724294 |
|---|---|
| CAS | 3966-32-3 |
| Molecular Weight (g/mol) | 166.176 |
| MDL Number | MFCD00004250 |
| SMILES | COC(C1=CC=CC=C1)C(=O)O |
| Synonym | r---alpha-methoxyphenylacetic acid,r-2-methoxy-2-phenylacetic acid,2r-2-methoxy-2-phenylacetic acid,r-methoxyphenylacetic acid,r-methoxy phenyl acetic acid,methoxy phenyl acetic acid #,r---.alpha.-methoxyphenylacetic acid,benzeneacetic acid, .alpha.-methoxy-, r,o-methyl-d-mandelic acid,ksc496q9j |
| IUPAC Name | (2R)-2-methoxy-2-phenylacetic acid |
| InChI Key | DIWVBIXQCNRCFE-MRVPVSSYSA-N |
| Molecular Formula | C9H10O3 |
m-Xylylene Dicyanide 98.0+%, TCI America™
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CAS: 626-22-2 Molecular Formula: C10H8N2 Molecular Weight (g/mol): 156.19 MDL Number: MFCD00001915 InChI Key: GRPFZJNUYXIVSL-UHFFFAOYSA-N Synonym: 1,3-phenylenediacetonitrile,1,3-benzenediacetonitrile,m-phenylenediacetonitrile,m-benzenediacetonitrile,acetonitrile, m-phenylenedi,2,2'-1,3-phenylene diacetonitrile,m-xylylene dicyanide,1,3-bis cyanomethyl benzene,m-bis cyanomethyl benzene,2-3-cyanomethyl phenyl acetonitrile PubChem CID: 69375 IUPAC Name: 2-[3-(cyanomethyl)phenyl]acetonitrile SMILES: N#CCC1=CC(CC#N)=CC=C1
| PubChem CID | 69375 |
|---|---|
| CAS | 626-22-2 |
| Molecular Weight (g/mol) | 156.19 |
| MDL Number | MFCD00001915 |
| SMILES | N#CCC1=CC(CC#N)=CC=C1 |
| Synonym | 1,3-phenylenediacetonitrile,1,3-benzenediacetonitrile,m-phenylenediacetonitrile,m-benzenediacetonitrile,acetonitrile, m-phenylenedi,2,2'-1,3-phenylene diacetonitrile,m-xylylene dicyanide,1,3-bis cyanomethyl benzene,m-bis cyanomethyl benzene,2-3-cyanomethyl phenyl acetonitrile |
| IUPAC Name | 2-[3-(cyanomethyl)phenyl]acetonitrile |
| InChI Key | GRPFZJNUYXIVSL-UHFFFAOYSA-N |
| Molecular Formula | C10H8N2 |
2,4-Dibromobenzyl Alcohol 98.0+%, TCI America™
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CAS: 666747-06-4 Molecular Formula: C7H6Br2O Molecular Weight (g/mol): 265.93 MDL Number: MFCD09996906 InChI Key: VXEVXBMLHQPKGA-UHFFFAOYSA-N Synonym: 2,4-dibromophenyl methanol,2,4-dibromobenzyl alcohol,benzenemethanol, 2,4-dibromo,2,4-dibromobenzenemethanol,benzenemethanol,2,4-dibromo,pubchem9781,2,4-dibromobenzylalcohol,acmc-1bfu5,2,4-bis bromanyl phenyl methanol PubChem CID: 17836195 IUPAC Name: (2,4-dibromophenyl)methanol SMILES: OCC1=C(Br)C=C(Br)C=C1
| PubChem CID | 17836195 |
|---|---|
| CAS | 666747-06-4 |
| Molecular Weight (g/mol) | 265.93 |
| MDL Number | MFCD09996906 |
| SMILES | OCC1=C(Br)C=C(Br)C=C1 |
| Synonym | 2,4-dibromophenyl methanol,2,4-dibromobenzyl alcohol,benzenemethanol, 2,4-dibromo,2,4-dibromobenzenemethanol,benzenemethanol,2,4-dibromo,pubchem9781,2,4-dibromobenzylalcohol,acmc-1bfu5,2,4-bis bromanyl phenyl methanol |
| IUPAC Name | (2,4-dibromophenyl)methanol |
| InChI Key | VXEVXBMLHQPKGA-UHFFFAOYSA-N |
| Molecular Formula | C7H6Br2O |
3-Iodobenzyl Cyanide 96.0+%, TCI America™
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CAS: 130723-54-5 Molecular Formula: C8H6IN Molecular Weight (g/mol): 243.05 MDL Number: MFCD00040890 InChI Key: LVOKGAHCTHNWIL-UHFFFAOYSA-N Synonym: 3-iodophenylacetonitrile,2-3-iodophenyl acetonitrile,3-iodobenzyl cyanide,3-iodophenyl acetonitrile,m-iodobenzyl cyanide,3-iodophenyacetonitrile,pubchem12771,3-iodo-1-phenylacetonitrile,acmc-1c0v0,benzeneacetonitrile, 3-iodo PubChem CID: 2759368 IUPAC Name: 2-(3-iodophenyl)acetonitrile SMILES: IC1=CC=CC(CC#N)=C1
| PubChem CID | 2759368 |
|---|---|
| CAS | 130723-54-5 |
| Molecular Weight (g/mol) | 243.05 |
| MDL Number | MFCD00040890 |
| SMILES | IC1=CC=CC(CC#N)=C1 |
| Synonym | 3-iodophenylacetonitrile,2-3-iodophenyl acetonitrile,3-iodobenzyl cyanide,3-iodophenyl acetonitrile,m-iodobenzyl cyanide,3-iodophenyacetonitrile,pubchem12771,3-iodo-1-phenylacetonitrile,acmc-1c0v0,benzeneacetonitrile, 3-iodo |
| IUPAC Name | 2-(3-iodophenyl)acetonitrile |
| InChI Key | LVOKGAHCTHNWIL-UHFFFAOYSA-N |
| Molecular Formula | C8H6IN |
4-Chloro-2-fluorobenzyl Bromide 98.0+%, TCI America™
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CAS: 71916-82-0 Molecular Formula: C7H5BrClF Molecular Weight (g/mol): 223.469 MDL Number: MFCD00831105 InChI Key: UFCSSWZQROEFBZ-UHFFFAOYSA-N Synonym: 1-bromomethyl-4-chloro-2-fluorobenzene,4-chloro-2-fluorobenzyl bromide,2-fluoro-4-chlorobenzyl bromide,4-chloro-2-fluorobenzylbromide,alpha-bromo-4-chloro-2-fluorotoluene,benzene, 1-bromomethyl-4-chloro-2-fluoro,pubchem4897,1-bromomethyl-4-chloro-2-fluoro-benzene,acmc-209okn PubChem CID: 2736551 IUPAC Name: 1-(bromomethyl)-4-chloro-2-fluorobenzene SMILES: C1=CC(=C(C=C1Cl)F)CBr
| PubChem CID | 2736551 |
|---|---|
| CAS | 71916-82-0 |
| Molecular Weight (g/mol) | 223.469 |
| MDL Number | MFCD00831105 |
| SMILES | C1=CC(=C(C=C1Cl)F)CBr |
| Synonym | 1-bromomethyl-4-chloro-2-fluorobenzene,4-chloro-2-fluorobenzyl bromide,2-fluoro-4-chlorobenzyl bromide,4-chloro-2-fluorobenzylbromide,alpha-bromo-4-chloro-2-fluorotoluene,benzene, 1-bromomethyl-4-chloro-2-fluoro,pubchem4897,1-bromomethyl-4-chloro-2-fluoro-benzene,acmc-209okn |
| IUPAC Name | 1-(bromomethyl)-4-chloro-2-fluorobenzene |
| InChI Key | UFCSSWZQROEFBZ-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrClF |
2,3-Dichlorobenzyl Cyanide 98.0+%, TCI America™
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CAS: 3218-45-9 Molecular Formula: C8H5Cl2N Molecular Weight (g/mol): 186.04 MDL Number: MFCD01861392 InChI Key: CZLINJDTCHACEH-UHFFFAOYSA-N Synonym: 2,3-Dichlorophenylacetonitrile PubChem CID: 229020 IUPAC Name: 2-(2,3-dichlorophenyl)acetonitrile SMILES: ClC1=CC=CC(CC#N)=C1Cl
| PubChem CID | 229020 |
|---|---|
| CAS | 3218-45-9 |
| Molecular Weight (g/mol) | 186.04 |
| MDL Number | MFCD01861392 |
| SMILES | ClC1=CC=CC(CC#N)=C1Cl |
| Synonym | 2,3-Dichlorophenylacetonitrile |
| IUPAC Name | 2-(2,3-dichlorophenyl)acetonitrile |
| InChI Key | CZLINJDTCHACEH-UHFFFAOYSA-N |
| Molecular Formula | C8H5Cl2N |
4-(Diethoxymethyl)-trans-stilbene 98.0+%, TCI America™
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CAS: 381716-24-1 Molecular Formula: C19H22O2 Molecular Weight (g/mol): 282.38 MDL Number: MFCD02093470 InChI Key: LKUHPNYFNZOTGE-UHFFFAOYSA-N Synonym: 4-Formyl-trans-stilbene Diethyl Acetal PubChem CID: 70700030 IUPAC Name: 1-(diethoxymethyl)-4-(2-phenylethenyl)benzene SMILES: CCOC(OCC)C1=CC=C(C=CC2=CC=CC=C2)C=C1
| PubChem CID | 70700030 |
|---|---|
| CAS | 381716-24-1 |
| Molecular Weight (g/mol) | 282.38 |
| MDL Number | MFCD02093470 |
| SMILES | CCOC(OCC)C1=CC=C(C=CC2=CC=CC=C2)C=C1 |
| Synonym | 4-Formyl-trans-stilbene Diethyl Acetal |
| IUPAC Name | 1-(diethoxymethyl)-4-(2-phenylethenyl)benzene |
| InChI Key | LKUHPNYFNZOTGE-UHFFFAOYSA-N |
| Molecular Formula | C19H22O2 |
3-Bromo-4-methoxybenzyl Cyanide 98.0+%, TCI America™
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CAS: 772-59-8 Molecular Formula: C9H8BrNO Molecular Weight (g/mol): 226.07 MDL Number: MFCD00016391 InChI Key: OBJKHHRZMIIEOK-UHFFFAOYSA-N Synonym: 3-bromo-4-methoxyphenylacetonitrile,3-bromo-4-methoxybenzyl cyanide,2-3-bromo-4-methoxyphenyl acetonitrile,benzeneacetonitrile, 3-bromo-4-methoxy,2-3-bromo-4-methoxyphenyl ethanenitrile,acmc-209p8t,benzeneacetonitrile,3-bromo-4-methoxy,3-bromo-4-methoxy-phenyl-acetonitrile,2-3-bromanyl-4-methoxy-phenyl ethanenitrile PubChem CID: 522655 IUPAC Name: 2-(3-bromo-4-methoxyphenyl)acetonitrile SMILES: COC1=C(Br)C=C(CC#N)C=C1
| PubChem CID | 522655 |
|---|---|
| CAS | 772-59-8 |
| Molecular Weight (g/mol) | 226.07 |
| MDL Number | MFCD00016391 |
| SMILES | COC1=C(Br)C=C(CC#N)C=C1 |
| Synonym | 3-bromo-4-methoxyphenylacetonitrile,3-bromo-4-methoxybenzyl cyanide,2-3-bromo-4-methoxyphenyl acetonitrile,benzeneacetonitrile, 3-bromo-4-methoxy,2-3-bromo-4-methoxyphenyl ethanenitrile,acmc-209p8t,benzeneacetonitrile,3-bromo-4-methoxy,3-bromo-4-methoxy-phenyl-acetonitrile,2-3-bromanyl-4-methoxy-phenyl ethanenitrile |
| IUPAC Name | 2-(3-bromo-4-methoxyphenyl)acetonitrile |
| InChI Key | OBJKHHRZMIIEOK-UHFFFAOYSA-N |
| Molecular Formula | C9H8BrNO |
Pentafluorobenzyl Alcohol 96.0+%, TCI America™
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CAS: 440-60-8 Molecular Formula: C7H3F5O Molecular Weight (g/mol): 198.092 MDL Number: MFCD00004602 InChI Key: PGJYYCIOYBZTPU-UHFFFAOYSA-N Synonym: 2,3,4,5,6-pentafluorobenzyl alcohol,pentafluorobenzyl alcohol,perfluorophenyl methanol,pentafluorophenyl methanol,2,3,4,5,6-pentafluorophenyl methanol,2,3,4,5,6-pentafluorobenzenemethanol,hydroxymethyl pentafluorobenzene,benzenemethanol, 2,3,4,5,6-pentafluoro,pentafluorobenzylalcohol,2,3,4,5,6-pentafluorobenzylalcohol PubChem CID: 9923 ChEBI: CHEBI:44903 IUPAC Name: (2,3,4,5,6-pentafluorophenyl)methanol SMILES: C(C1=C(C(=C(C(=C1F)F)F)F)F)O
| PubChem CID | 9923 |
|---|---|
| CAS | 440-60-8 |
| Molecular Weight (g/mol) | 198.092 |
| ChEBI | CHEBI:44903 |
| MDL Number | MFCD00004602 |
| SMILES | C(C1=C(C(=C(C(=C1F)F)F)F)F)O |
| Synonym | 2,3,4,5,6-pentafluorobenzyl alcohol,pentafluorobenzyl alcohol,perfluorophenyl methanol,pentafluorophenyl methanol,2,3,4,5,6-pentafluorophenyl methanol,2,3,4,5,6-pentafluorobenzenemethanol,hydroxymethyl pentafluorobenzene,benzenemethanol, 2,3,4,5,6-pentafluoro,pentafluorobenzylalcohol,2,3,4,5,6-pentafluorobenzylalcohol |
| IUPAC Name | (2,3,4,5,6-pentafluorophenyl)methanol |
| InChI Key | PGJYYCIOYBZTPU-UHFFFAOYSA-N |
| Molecular Formula | C7H3F5O |
2-Chloro-6-fluorobenzyl Chloride 98.0+%, TCI America™
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CAS: 55117-15-2 Molecular Formula: C7H5Cl2F Molecular Weight (g/mol): 179.02 MDL Number: MFCD00000896 InChI Key: MJGOLNNLNQQIHR-UHFFFAOYSA-N Synonym: 2-chloro-6-fluorobenzyl chloride,1-chloro-2-chloromethyl-3-fluorobenzene,benzene, 1-chloro-2-chloromethyl-3-fluoro,2-chloro-6-fluorobenzylchloride,unii-a581kl6zpn,1-chloro-2-chloromethyl-3-fluoro-benzene,alpha,2-dichloro-6-fluorotoluene,a581kl6zpn,3-chloro-2-chloromethyl-1-fluorobenzene,pubchem7497 PubChem CID: 108675 IUPAC Name: 1-chloro-2-(chloromethyl)-3-fluorobenzene SMILES: FC1=CC=CC(Cl)=C1CCl
| PubChem CID | 108675 |
|---|---|
| CAS | 55117-15-2 |
| Molecular Weight (g/mol) | 179.02 |
| MDL Number | MFCD00000896 |
| SMILES | FC1=CC=CC(Cl)=C1CCl |
| Synonym | 2-chloro-6-fluorobenzyl chloride,1-chloro-2-chloromethyl-3-fluorobenzene,benzene, 1-chloro-2-chloromethyl-3-fluoro,2-chloro-6-fluorobenzylchloride,unii-a581kl6zpn,1-chloro-2-chloromethyl-3-fluoro-benzene,alpha,2-dichloro-6-fluorotoluene,a581kl6zpn,3-chloro-2-chloromethyl-1-fluorobenzene,pubchem7497 |
| IUPAC Name | 1-chloro-2-(chloromethyl)-3-fluorobenzene |
| InChI Key | MJGOLNNLNQQIHR-UHFFFAOYSA-N |
| Molecular Formula | C7H5Cl2F |
5-Bromo-2-chlorobenzyl Alcohol 98.0+%, TCI America™
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CAS: 149965-40-2 Molecular Formula: C7H6BrClO Molecular Weight (g/mol): 221.48 MDL Number: MFCD02683548 InChI Key: SCHBQPIVMBDOQF-UHFFFAOYSA-N PubChem CID: 5074766 IUPAC Name: (5-bromo-2-chlorophenyl)methanol SMILES: OCC1=C(Cl)C=CC(Br)=C1
| PubChem CID | 5074766 |
|---|---|
| CAS | 149965-40-2 |
| Molecular Weight (g/mol) | 221.48 |
| MDL Number | MFCD02683548 |
| SMILES | OCC1=C(Cl)C=CC(Br)=C1 |
| IUPAC Name | (5-bromo-2-chlorophenyl)methanol |
| InChI Key | SCHBQPIVMBDOQF-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrClO |
4-Fluorobenzyl Cyanide 98.0+%, TCI America™
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CAS: 459-22-3 Molecular Formula: C8H6FN Molecular Weight (g/mol): 135.141 MDL Number: MFCD00001917 InChI Key: JHQBLYITVCBGTO-UHFFFAOYSA-N Synonym: 4-fluorophenylacetonitrile,4-fluorobenzyl cyanide,p-fluorobenzyl cyanide,benzeneacetonitrile, 4-fluoro,4-fluorobenzylcyanide,4-fluorobenzeneacetonitrile,p-fluorophenylacetonitrile,2-4-fluorophenyl acetonitrile,4-fluorobenzylnitrile,acetonitrile, p-fluorophenyl PubChem CID: 68016 IUPAC Name: 2-(4-fluorophenyl)acetonitrile SMILES: C1=CC(=CC=C1CC#N)F
| PubChem CID | 68016 |
|---|---|
| CAS | 459-22-3 |
| Molecular Weight (g/mol) | 135.141 |
| MDL Number | MFCD00001917 |
| SMILES | C1=CC(=CC=C1CC#N)F |
| Synonym | 4-fluorophenylacetonitrile,4-fluorobenzyl cyanide,p-fluorobenzyl cyanide,benzeneacetonitrile, 4-fluoro,4-fluorobenzylcyanide,4-fluorobenzeneacetonitrile,p-fluorophenylacetonitrile,2-4-fluorophenyl acetonitrile,4-fluorobenzylnitrile,acetonitrile, p-fluorophenyl |
| IUPAC Name | 2-(4-fluorophenyl)acetonitrile |
| InChI Key | JHQBLYITVCBGTO-UHFFFAOYSA-N |
| Molecular Formula | C8H6FN |
2-Cyanophenylacetonitrile 98.0+%, TCI America™
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CAS: 3759-28-2 Molecular Formula: C9H6N2 Molecular Weight (g/mol): 142.16 MDL Number: MFCD00001895 InChI Key: GKHSEDFDYXZGCG-UHFFFAOYSA-N Synonym: 2-cyanomethyl benzonitrile,homophthalonitrile,2-cyanobenzyl cyanide,2-cyanophenylacetonitrile,alpha-cyano-o-tolunitrile,o-cyanobenzyl cyanide,benzeneacetonitrile, 2-cyano,2-cyanobenzeneacetonitrile,o-cyanophenyl acetonitrile,o-tolunitrile, alpha-cyano PubChem CID: 77368 IUPAC Name: 2-(cyanomethyl)benzonitrile SMILES: N#CCC1=CC=CC=C1C#N
| PubChem CID | 77368 |
|---|---|
| CAS | 3759-28-2 |
| Molecular Weight (g/mol) | 142.16 |
| MDL Number | MFCD00001895 |
| SMILES | N#CCC1=CC=CC=C1C#N |
| Synonym | 2-cyanomethyl benzonitrile,homophthalonitrile,2-cyanobenzyl cyanide,2-cyanophenylacetonitrile,alpha-cyano-o-tolunitrile,o-cyanobenzyl cyanide,benzeneacetonitrile, 2-cyano,2-cyanobenzeneacetonitrile,o-cyanophenyl acetonitrile,o-tolunitrile, alpha-cyano |
| IUPAC Name | 2-(cyanomethyl)benzonitrile |
| InChI Key | GKHSEDFDYXZGCG-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2 |
1,6-Di-O-acetyl-2,3,4-tri-O-benzyl-alpha-D-mannopyranose 95.0+%, TCI America™
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CAS: 65556-30-1 Molecular Formula: C31H34O8 Molecular Weight (g/mol): 534.605 InChI Key: IFCAMEQHKHEHBS-YOGXEWEVSA-N PubChem CID: 10840038 IUPAC Name: [(2R,3R,4S,5S,6R)-6-acetyloxy-3,4,5-tris(phenylmethoxy)oxan-2-yl]methyl acetate SMILES: CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4
| PubChem CID | 10840038 |
|---|---|
| CAS | 65556-30-1 |
| Molecular Weight (g/mol) | 534.605 |
| SMILES | CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4 |
| IUPAC Name | [(2R,3R,4S,5S,6R)-6-acetyloxy-3,4,5-tris(phenylmethoxy)oxan-2-yl]methyl acetate |
| InChI Key | IFCAMEQHKHEHBS-YOGXEWEVSA-N |
| Molecular Formula | C31H34O8 |