Benzene and substituted derivatives
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4-Bromomethyl-3-fluorobenzonitrile, 95%, Thermo Scientific Chemicals
CAS: 105942-09-4 Molecular Formula: C8H5BrFN Molecular Weight (g/mol): 214.04 MDL Number: MFCD07368341 InChI Key: ZESZAIOGACKOMB-UHFFFAOYSA-N Synonym: 4-bromomethyl-3-fluorobenzonitrile,4-cyano-2-fluorobenzyl bromide,2-fluoro-4-cyanobenzyl bromide,2-fluoro-4-cyanbenzyl bromide,benzonitrile, 4-bromomethyl-3-fluoro,2-fluoro-4-cyanobenzylbromide,3-fluoro-4-bromomethyl benzonitrile,4-bromomethyl-3-fluoro-benzonitrile,4-bromomethyl-3-fluorobenzenecarbonitrile,pubchem4907 PubChem CID: 2783149 IUPAC Name: 4-(bromomethyl)-3-fluorobenzonitrile SMILES: FC1=C(CBr)C=CC(=C1)C#N
| PubChem CID | 2783149 |
|---|---|
| CAS | 105942-09-4 |
| Molecular Weight (g/mol) | 214.04 |
| MDL Number | MFCD07368341 |
| SMILES | FC1=C(CBr)C=CC(=C1)C#N |
| Synonym | 4-bromomethyl-3-fluorobenzonitrile,4-cyano-2-fluorobenzyl bromide,2-fluoro-4-cyanobenzyl bromide,2-fluoro-4-cyanbenzyl bromide,benzonitrile, 4-bromomethyl-3-fluoro,2-fluoro-4-cyanobenzylbromide,3-fluoro-4-bromomethyl benzonitrile,4-bromomethyl-3-fluoro-benzonitrile,4-bromomethyl-3-fluorobenzenecarbonitrile,pubchem4907 |
| IUPAC Name | 4-(bromomethyl)-3-fluorobenzonitrile |
| InChI Key | ZESZAIOGACKOMB-UHFFFAOYSA-N |
| Molecular Formula | C8H5BrFN |
3-Fluorophenylacetonitrile, 99%
CAS: 501-00-8 Molecular Formula: C8H6FN Molecular Weight (g/mol): 135.141 MDL Number: MFCD00001907 InChI Key: DEJPYROXSVVWIE-UHFFFAOYSA-N Synonym: 3-fluorophenylacetonitrile,3-fluorobenzyl cyanide,2-3-fluorophenyl acetonitrile,m-fluorophenylacetonitrile,benzeneacetonitrile, 3-fluoro,3-fluorobenzeneacetonitrile,m-fluorobenzyl cyanide,acetonitrile, m-fluorophenyl,3-fluorophenyl acetonitrile,2-3-fluorophenyl ethanenitrile PubChem CID: 68145 IUPAC Name: 2-(3-fluorophenyl)acetonitrile SMILES: C1=CC(=CC(=C1)F)CC#N
| PubChem CID | 68145 |
|---|---|
| CAS | 501-00-8 |
| Molecular Weight (g/mol) | 135.141 |
| MDL Number | MFCD00001907 |
| SMILES | C1=CC(=CC(=C1)F)CC#N |
| Synonym | 3-fluorophenylacetonitrile,3-fluorobenzyl cyanide,2-3-fluorophenyl acetonitrile,m-fluorophenylacetonitrile,benzeneacetonitrile, 3-fluoro,3-fluorobenzeneacetonitrile,m-fluorobenzyl cyanide,acetonitrile, m-fluorophenyl,3-fluorophenyl acetonitrile,2-3-fluorophenyl ethanenitrile |
| IUPAC Name | 2-(3-fluorophenyl)acetonitrile |
| InChI Key | DEJPYROXSVVWIE-UHFFFAOYSA-N |
| Molecular Formula | C8H6FN |
(S)-(-)-2-Amino-3-benzyloxy-1-propanol, 98+%
CAS: 58577-88-1 Molecular Formula: C10H15NO2 Molecular Weight (g/mol): 181.235 MDL Number: MFCD04112477 InChI Key: ZJUOMDNENVWMPL-JTQLQIEISA-N Synonym: s-2-amino-3-benzyloxy-1-propanol,h-d-ser bzl-ol,2s-2-amino-3-benzyloxy propan-1-ol,s-2-amino-3-benzyloxy propan-1-ol,1-propanol, 2-amino-3-phenylmethoxy-, 2s,s---2-amino-3-benzyloxy-1-propanol, 98+%,ambotzhal1035,s---2-amino-3-benzyloxy-1-propal,s---2-amino-3-benzyloxy-1-propanol PubChem CID: 11401131 IUPAC Name: (2S)-2-amino-3-phenylmethoxypropan-1-ol SMILES: C1=CC=C(C=C1)COCC(CO)N
| PubChem CID | 11401131 |
|---|---|
| CAS | 58577-88-1 |
| Molecular Weight (g/mol) | 181.235 |
| MDL Number | MFCD04112477 |
| SMILES | C1=CC=C(C=C1)COCC(CO)N |
| Synonym | s-2-amino-3-benzyloxy-1-propanol,h-d-ser bzl-ol,2s-2-amino-3-benzyloxy propan-1-ol,s-2-amino-3-benzyloxy propan-1-ol,1-propanol, 2-amino-3-phenylmethoxy-, 2s,s---2-amino-3-benzyloxy-1-propanol, 98+%,ambotzhal1035,s---2-amino-3-benzyloxy-1-propal,s---2-amino-3-benzyloxy-1-propanol |
| IUPAC Name | (2S)-2-amino-3-phenylmethoxypropan-1-ol |
| InChI Key | ZJUOMDNENVWMPL-JTQLQIEISA-N |
| Molecular Formula | C10H15NO2 |
{2-[1-Methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]phenyl}methanol, 97%, Thermo Scientific™
CAS: 892502-29-3 Molecular Formula: C12H11F3N2O Molecular Weight (g/mol): 256.228 MDL Number: MFCD09817511 InChI Key: HLMRFDCLSUXVQC-UHFFFAOYSA-N Synonym: 2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl phenyl methanol,2-2-methyl-5-trifluoromethyl pyrazol-3-yl phenyl methanol,2-1-methyl-3-trifluoromethyl pyrazol-5-yl phenyl methan-1-ol,2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl benzyl alcohol,benzenemethanol,2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl PubChem CID: 24229659 IUPAC Name: [2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]phenyl]methanol SMILES: CN1C(=CC(=N1)C(F)(F)F)C2=CC=CC=C2CO
| PubChem CID | 24229659 |
|---|---|
| CAS | 892502-29-3 |
| Molecular Weight (g/mol) | 256.228 |
| MDL Number | MFCD09817511 |
| SMILES | CN1C(=CC(=N1)C(F)(F)F)C2=CC=CC=C2CO |
| Synonym | 2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl phenyl methanol,2-2-methyl-5-trifluoromethyl pyrazol-3-yl phenyl methanol,2-1-methyl-3-trifluoromethyl pyrazol-5-yl phenyl methan-1-ol,2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl benzyl alcohol,benzenemethanol,2-1-methyl-3-trifluoromethyl-1h-pyrazol-5-yl |
| IUPAC Name | [2-[2-methyl-5-(trifluoromethyl)pyrazol-3-yl]phenyl]methanol |
| InChI Key | HLMRFDCLSUXVQC-UHFFFAOYSA-N |
| Molecular Formula | C12H11F3N2O |
Methyl 4-(bromomethyl)benzoate, 98%
CAS: 2417-72-3 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00032453 InChI Key: NLWBJPPMPLPZIE-UHFFFAOYSA-N PubChem CID: 256687 IUPAC Name: methyl 4-(bromomethyl)benzoate SMILES: COC(=O)C1=CC=C(CBr)C=C1
| PubChem CID | 256687 |
|---|---|
| CAS | 2417-72-3 |
| Molecular Weight (g/mol) | 229.07 |
| MDL Number | MFCD00032453 |
| SMILES | COC(=O)C1=CC=C(CBr)C=C1 |
| IUPAC Name | methyl 4-(bromomethyl)benzoate |
| InChI Key | NLWBJPPMPLPZIE-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
2,4,6-Trimethoxybenzyl alcohol, 97%
CAS: 61040-78-6 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.218 MDL Number: MFCD00060356 InChI Key: CFXXBVNHYJQNKS-UHFFFAOYSA-N PubChem CID: 602515 IUPAC Name: (2,4,6-trimethoxyphenyl)methanol SMILES: COC1=CC(=C(C(=C1)OC)CO)OC
| PubChem CID | 602515 |
|---|---|
| CAS | 61040-78-6 |
| Molecular Weight (g/mol) | 198.218 |
| MDL Number | MFCD00060356 |
| SMILES | COC1=CC(=C(C(=C1)OC)CO)OC |
| IUPAC Name | (2,4,6-trimethoxyphenyl)methanol |
| InChI Key | CFXXBVNHYJQNKS-UHFFFAOYSA-N |
| Molecular Formula | C10H14O4 |
(3-Pyrimidin-2-ylphenyl)methanol, 97%, Thermo Scientific™
CAS: 892502-12-4 Molecular Formula: C11H10N2O Molecular Weight (g/mol): 186.21 MDL Number: MFCD09064977 InChI Key: WMNXGJMCXOLBBV-UHFFFAOYSA-N Synonym: 3-pyrimidin-2-ylphenyl methanol,3-pyrimidin-2-yl phenyl methanol,benzenemethanol,3-2-pyrimidinyl,3-pyrimidin-2-yl-benzyl alcohol,benzenemethanol, 3-2-pyrimidinyl,3-pyrimidin-2-ylphenyl methan-1-ol PubChem CID: 24229565 SMILES: OCC1=CC=CC(=C1)C1=NC=CC=N1
| PubChem CID | 24229565 |
|---|---|
| CAS | 892502-12-4 |
| Molecular Weight (g/mol) | 186.21 |
| MDL Number | MFCD09064977 |
| SMILES | OCC1=CC=CC(=C1)C1=NC=CC=N1 |
| Synonym | 3-pyrimidin-2-ylphenyl methanol,3-pyrimidin-2-yl phenyl methanol,benzenemethanol,3-2-pyrimidinyl,3-pyrimidin-2-yl-benzyl alcohol,benzenemethanol, 3-2-pyrimidinyl,3-pyrimidin-2-ylphenyl methan-1-ol |
| InChI Key | WMNXGJMCXOLBBV-UHFFFAOYSA-N |
| Molecular Formula | C11H10N2O |
3-Bromo-4-methoxyphenylacetonitrile, 99%
CAS: 772-59-8 Molecular Formula: C9H8BrNO Molecular Weight (g/mol): 226.07 MDL Number: MFCD00016391 InChI Key: OBJKHHRZMIIEOK-UHFFFAOYSA-N 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 |
| IUPAC Name | 2-(3-bromo-4-methoxyphenyl)acetonitrile |
| InChI Key | OBJKHHRZMIIEOK-UHFFFAOYSA-N |
| Molecular Formula | C9H8BrNO |
alpha-Chloro-p-xylene, 98%
CAS: 104-82-5 Molecular Formula: C8H9Cl Molecular Weight (g/mol): 140.61 MDL Number: MFCD00000919 InChI Key: DMHZDOTYAVHSEH-UHFFFAOYSA-N Synonym: 4-methylbenzyl chloride,p-xylyl chloride,1-chloromethyl-4-methylbenzene,alpha-chloro-p-xylene,p-methylbenzyl chloride,benzene, 1-chloromethyl-4-methyl,p-chloromethyl toluene,4-chloromethyl toluene,p-tolylmethyl chloride,p-xylene, alpha-chloro PubChem CID: 7722 IUPAC Name: 1-(chloromethyl)-4-methylbenzene SMILES: CC1=CC=C(C=C1)CCl
| PubChem CID | 7722 |
|---|---|
| CAS | 104-82-5 |
| Molecular Weight (g/mol) | 140.61 |
| MDL Number | MFCD00000919 |
| SMILES | CC1=CC=C(C=C1)CCl |
| Synonym | 4-methylbenzyl chloride,p-xylyl chloride,1-chloromethyl-4-methylbenzene,alpha-chloro-p-xylene,p-methylbenzyl chloride,benzene, 1-chloromethyl-4-methyl,p-chloromethyl toluene,4-chloromethyl toluene,p-tolylmethyl chloride,p-xylene, alpha-chloro |
| IUPAC Name | 1-(chloromethyl)-4-methylbenzene |
| InChI Key | DMHZDOTYAVHSEH-UHFFFAOYSA-N |
| Molecular Formula | C8H9Cl |
alpha-Bromo-o-tolunitrile, 98%
CAS: 22115-41-9 Molecular Formula: C8H6BrN Molecular Weight (g/mol): 196.05 MDL Number: MFCD00001794 InChI Key: QGXNHCXKWFNKCG-UHFFFAOYSA-N Synonym: 2-bromomethyl benzonitrile,2-cyanobenzyl bromide,alpha-bromo-o-tolunitrile,o-cyanobenzyl bromide,a-bromo-o-tolunitrile,alpha bromo-o-tolunitrile,2 bromomethyl benzonitrile,2-bromomethyl-benzonitrile,2-cyanophenyl methyl bromide,benzonitrile, 2-bromomethyl PubChem CID: 89599 IUPAC Name: 2-(bromomethyl)benzonitrile SMILES: BrCC1=CC=CC=C1C#N
| PubChem CID | 89599 |
|---|---|
| CAS | 22115-41-9 |
| Molecular Weight (g/mol) | 196.05 |
| MDL Number | MFCD00001794 |
| SMILES | BrCC1=CC=CC=C1C#N |
| Synonym | 2-bromomethyl benzonitrile,2-cyanobenzyl bromide,alpha-bromo-o-tolunitrile,o-cyanobenzyl bromide,a-bromo-o-tolunitrile,alpha bromo-o-tolunitrile,2 bromomethyl benzonitrile,2-bromomethyl-benzonitrile,2-cyanophenyl methyl bromide,benzonitrile, 2-bromomethyl |
| IUPAC Name | 2-(bromomethyl)benzonitrile |
| InChI Key | QGXNHCXKWFNKCG-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrN |
4-Bromobenzyl bromide, 98%
CAS: 589-15-1 Molecular Formula: C7H6Br2 Molecular Weight (g/mol): 249.93 MDL Number: MFCD00000179 InChI Key: YLRBJYMANQKEAW-UHFFFAOYSA-N Synonym: 4-bromobenzyl bromide,1-bromo-4-bromomethyl benzene,p-bromobenzyl bromide,alpha,p-dibromotoluene,alpha,4-dibromotoluene,benzene, 1-bromo-4-bromomethyl,4-bromobenzylbromide,unii-3d1ttl8bgn,a,p-dibromotoluene,4-bromo benzyl bromide PubChem CID: 68527 IUPAC Name: 1-bromo-4-(bromomethyl)benzene SMILES: C1=CC(=CC=C1CBr)Br
| PubChem CID | 68527 |
|---|---|
| CAS | 589-15-1 |
| Molecular Weight (g/mol) | 249.93 |
| MDL Number | MFCD00000179 |
| SMILES | C1=CC(=CC=C1CBr)Br |
| Synonym | 4-bromobenzyl bromide,1-bromo-4-bromomethyl benzene,p-bromobenzyl bromide,alpha,p-dibromotoluene,alpha,4-dibromotoluene,benzene, 1-bromo-4-bromomethyl,4-bromobenzylbromide,unii-3d1ttl8bgn,a,p-dibromotoluene,4-bromo benzyl bromide |
| IUPAC Name | 1-bromo-4-(bromomethyl)benzene |
| InChI Key | YLRBJYMANQKEAW-UHFFFAOYSA-N |
| Molecular Formula | C7H6Br2 |
2,4-Dichlorobenzyl chloride, 98%
CAS: 94-99-5 Molecular Formula: C7H5Cl3 Molecular Weight (g/mol): 195.47 MDL Number: MFCD00000895 InChI Key: IRSVDHPYXFLLDS-UHFFFAOYSA-N Synonym: 2,4-dichlorobenzyl chloride,2,4-dichloro-1-chloromethyl benzene,2,4-dichlorobenzylchloride,alpha,2,4-trichlorotoluene,benzene, 2,4-dichloro-1-chloromethyl,2,4-dichloro-1-chloromethyl-benzene,alpha2,4-trichlorotoluene,unii-85e96p2s3s,2,4-dcbc,toluene, .alpha.2,4-trichloro PubChem CID: 7212 IUPAC Name: 2,4-dichloro-1-(chloromethyl)benzene SMILES: ClCC1=CC=C(Cl)C=C1Cl
| PubChem CID | 7212 |
|---|---|
| CAS | 94-99-5 |
| Molecular Weight (g/mol) | 195.47 |
| MDL Number | MFCD00000895 |
| SMILES | ClCC1=CC=C(Cl)C=C1Cl |
| Synonym | 2,4-dichlorobenzyl chloride,2,4-dichloro-1-chloromethyl benzene,2,4-dichlorobenzylchloride,alpha,2,4-trichlorotoluene,benzene, 2,4-dichloro-1-chloromethyl,2,4-dichloro-1-chloromethyl-benzene,alpha2,4-trichlorotoluene,unii-85e96p2s3s,2,4-dcbc,toluene, .alpha.2,4-trichloro |
| IUPAC Name | 2,4-dichloro-1-(chloromethyl)benzene |
| InChI Key | IRSVDHPYXFLLDS-UHFFFAOYSA-N |
| Molecular Formula | C7H5Cl3 |
3-Nitrobenzyl bromide, 98+%
CAS: 3958-57-4 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.034 MDL Number: MFCD00007271 InChI Key: LNWXALCHPJANMJ-UHFFFAOYSA-N Synonym: 3-nitrobenzyl bromide,1-bromomethyl-3-nitrobenzene,m-nitrobenzyl bromide,benzene, 1-bromomethyl-3-nitro,alpha-bromo-3-nitrotoluene,m-bromomethyl nitrobenzene,alpha-bromo-m-nitrotoluene,m-nitro-alpha-bromotoluene,3-nitrobenzylbromide,toluene, alpha-bromo-m-nitro PubChem CID: 77568 IUPAC Name: 1-(bromomethyl)-3-nitrobenzene SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])CBr
| PubChem CID | 77568 |
|---|---|
| CAS | 3958-57-4 |
| Molecular Weight (g/mol) | 216.034 |
| MDL Number | MFCD00007271 |
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])CBr |
| Synonym | 3-nitrobenzyl bromide,1-bromomethyl-3-nitrobenzene,m-nitrobenzyl bromide,benzene, 1-bromomethyl-3-nitro,alpha-bromo-3-nitrotoluene,m-bromomethyl nitrobenzene,alpha-bromo-m-nitrotoluene,m-nitro-alpha-bromotoluene,3-nitrobenzylbromide,toluene, alpha-bromo-m-nitro |
| IUPAC Name | 1-(bromomethyl)-3-nitrobenzene |
| InChI Key | LNWXALCHPJANMJ-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrNO2 |
3-Bromobenzyl chloride, 97%
CAS: 932-77-4 Molecular Formula: C7H6BrCl Molecular Weight (g/mol): 205.479 MDL Number: MFCD00040865 InChI Key: UDKGXKYEWBGQCG-UHFFFAOYSA-N Synonym: 3-bromobenzyl chloride,1-bromo-3-chloromethyl benzene,3-bromo-alpha-chlorotoluene,m-bromobenzyl chloride,benzene, 1-bromo-3-chloromethyl,3-bromo-a-chlorotoluene,3-bromobenzylchloride,pubchem23319,acmc-209rkw,bromo-3-chloromethyl-benzene PubChem CID: 523059 IUPAC Name: 1-bromo-3-(chloromethyl)benzene SMILES: C1=CC(=CC(=C1)Br)CCl
| PubChem CID | 523059 |
|---|---|
| CAS | 932-77-4 |
| Molecular Weight (g/mol) | 205.479 |
| MDL Number | MFCD00040865 |
| SMILES | C1=CC(=CC(=C1)Br)CCl |
| Synonym | 3-bromobenzyl chloride,1-bromo-3-chloromethyl benzene,3-bromo-alpha-chlorotoluene,m-bromobenzyl chloride,benzene, 1-bromo-3-chloromethyl,3-bromo-a-chlorotoluene,3-bromobenzylchloride,pubchem23319,acmc-209rkw,bromo-3-chloromethyl-benzene |
| IUPAC Name | 1-bromo-3-(chloromethyl)benzene |
| InChI Key | UDKGXKYEWBGQCG-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrCl |
2-Methoxybenzonitrile, 99%
CAS: 6609-56-9 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00001783 InChI Key: FSTPMFASNVISBU-UHFFFAOYSA-N Synonym: 2-cyanoanisole,o-methoxybenzonitrile,2-methoxy-benzonitrile,benzonitrile, 2-methoxy,2-methoxybenzenecarbonitrile,o-anisolnitrile,o-anisonitrile,methoxybenzonitrile,2-methxybenzonitrile,o-methyoxybenzonitrile PubChem CID: 81086 IUPAC Name: 2-methoxybenzonitrile SMILES: COC1=CC=CC=C1C#N
| PubChem CID | 81086 |
|---|---|
| CAS | 6609-56-9 |
| Molecular Weight (g/mol) | 133.15 |
| MDL Number | MFCD00001783 |
| SMILES | COC1=CC=CC=C1C#N |
| Synonym | 2-cyanoanisole,o-methoxybenzonitrile,2-methoxy-benzonitrile,benzonitrile, 2-methoxy,2-methoxybenzenecarbonitrile,o-anisolnitrile,o-anisonitrile,methoxybenzonitrile,2-methxybenzonitrile,o-methyoxybenzonitrile |
| IUPAC Name | 2-methoxybenzonitrile |
| InChI Key | FSTPMFASNVISBU-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO |