Benzenoids
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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 |
3-Aminobenzyl alcohol, 98+%
CAS: 1877-77-6 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.16 MDL Number: MFCD00007817 InChI Key: OJZQOQNSUZLSMV-UHFFFAOYSA-N Synonym: 3-aminobenzyl alcohol,3-aminophenyl methanol,m-aminobenzyl alcohol,3-aminobenzylalcohol,3-hydroxymethyl aniline,benzenemethanol, 3-amino,benzyl alcohol, m-amino,3-aminobenzenemethanol,unii-kn96abq0sp,m-aminophenylcarbinol PubChem CID: 80293 IUPAC Name: (3-aminophenyl)methanol SMILES: NC1=CC=CC(CO)=C1
| PubChem CID | 80293 |
|---|---|
| CAS | 1877-77-6 |
| Molecular Weight (g/mol) | 123.16 |
| MDL Number | MFCD00007817 |
| SMILES | NC1=CC=CC(CO)=C1 |
| Synonym | 3-aminobenzyl alcohol,3-aminophenyl methanol,m-aminobenzyl alcohol,3-aminobenzylalcohol,3-hydroxymethyl aniline,benzenemethanol, 3-amino,benzyl alcohol, m-amino,3-aminobenzenemethanol,unii-kn96abq0sp,m-aminophenylcarbinol |
| IUPAC Name | (3-aminophenyl)methanol |
| InChI Key | OJZQOQNSUZLSMV-UHFFFAOYSA-N |
| Molecular Formula | C7H9NO |
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 |
p-Anisaldehyde dimethyl acetal, 98%
CAS: 2186-92-7 Molecular Formula: C10H14O3 Molecular Weight (g/mol): 182.22 MDL Number: MFCD00036507 InChI Key: NNHYAHOTXLASEA-UHFFFAOYSA-N Synonym: 1-dimethoxymethyl-4-methoxybenzene,p-anisaldehyde dimethyl acetal,anisaldehyde dimethyl acetal,4-methoxybenzaldehyde dimethyl acetal,p-dimethoxymethyl anisole,benzene, 1-dimethoxymethyl-4-methoxy,p-anisaldehydedimethylacetal,unii-xte77a5et4,anisicaldehyde dimethylacetal,p-anisaldehyde dimethylacetal PubChem CID: 75140 IUPAC Name: 1-(dimethoxymethyl)-4-methoxybenzene SMILES: COC(OC)C1=CC=C(OC)C=C1
| PubChem CID | 75140 |
|---|---|
| CAS | 2186-92-7 |
| Molecular Weight (g/mol) | 182.22 |
| MDL Number | MFCD00036507 |
| SMILES | COC(OC)C1=CC=C(OC)C=C1 |
| Synonym | 1-dimethoxymethyl-4-methoxybenzene,p-anisaldehyde dimethyl acetal,anisaldehyde dimethyl acetal,4-methoxybenzaldehyde dimethyl acetal,p-dimethoxymethyl anisole,benzene, 1-dimethoxymethyl-4-methoxy,p-anisaldehydedimethylacetal,unii-xte77a5et4,anisicaldehyde dimethylacetal,p-anisaldehyde dimethylacetal |
| IUPAC Name | 1-(dimethoxymethyl)-4-methoxybenzene |
| InChI Key | NNHYAHOTXLASEA-UHFFFAOYSA-N |
| Molecular Formula | C10H14O3 |
Benzyl Alcohol, ACS, 99%, Spectrum™ Chemical
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CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N IUPAC Name: phenylmethanol SMILES: OCC1=CC=CC=C1
| CAS | 100-51-6 |
|---|---|
| Molecular Weight (g/mol) | 108.14 |
| SMILES | OCC1=CC=CC=C1 |
| IUPAC Name | phenylmethanol |
| InChI Key | WVDDGKGOMKODPV-UHFFFAOYSA-N |
| Molecular Formula | C7H8O |
[4-(Pyrid-2-yloxy)phenyl]methanol, 97%, Thermo Scientific™
CAS: 194017-70-4 Molecular Formula: C12H11NO2 Molecular Weight (g/mol): 201.23 MDL Number: MFCD08690278 InChI Key: ZDTXOQRCIVCMLT-UHFFFAOYSA-N Synonym: 4-pyrid-2-yloxy phenyl methanol,4-pyridin-2-yloxy phenyl methanol,4-2-pyridyloxy phenyl methanol,4-pyridin-2-yl oxy phenyl,2-4-hydroxymethylphenoxy pyridine,4-2-pyridyloxy phenyl methan-1-ol,4-pyridin-2-yl oxy phenyl methanol PubChem CID: 17859715 SMILES: OCC1=CC=C(OC2=CC=CC=N2)C=C1
| PubChem CID | 17859715 |
|---|---|
| CAS | 194017-70-4 |
| Molecular Weight (g/mol) | 201.23 |
| MDL Number | MFCD08690278 |
| SMILES | OCC1=CC=C(OC2=CC=CC=N2)C=C1 |
| Synonym | 4-pyrid-2-yloxy phenyl methanol,4-pyridin-2-yloxy phenyl methanol,4-2-pyridyloxy phenyl methanol,4-pyridin-2-yl oxy phenyl,2-4-hydroxymethylphenoxy pyridine,4-2-pyridyloxy phenyl methan-1-ol,4-pyridin-2-yl oxy phenyl methanol |
| InChI Key | ZDTXOQRCIVCMLT-UHFFFAOYSA-N |
| Molecular Formula | C12H11NO2 |
2,3-Dichlorobenzyl bromide, 99%
CAS: 57915-78-3 Molecular Formula: C7H5BrCl2 Molecular Weight (g/mol): 239.921 MDL Number: MFCD03701317 InChI Key: PVIGUZZDWGININ-UHFFFAOYSA-N Synonym: 2,3-dichlorobenzyl bromide,1-bromomethyl-2,3-dichlorobenzene,2,3-dichlorobenzylbromide,alpha-bromo-2,3-dichlorotoluene,benzene,1-bromomethyl-2,3-dichloro,benzene, 1-bromomethyl-2,3-dichloro,acmc-209m1b PubChem CID: 2734602 IUPAC Name: 1-(bromomethyl)-2,3-dichlorobenzene SMILES: C1=CC(=C(C(=C1)Cl)Cl)CBr
| PubChem CID | 2734602 |
|---|---|
| CAS | 57915-78-3 |
| Molecular Weight (g/mol) | 239.921 |
| MDL Number | MFCD03701317 |
| SMILES | C1=CC(=C(C(=C1)Cl)Cl)CBr |
| Synonym | 2,3-dichlorobenzyl bromide,1-bromomethyl-2,3-dichlorobenzene,2,3-dichlorobenzylbromide,alpha-bromo-2,3-dichlorotoluene,benzene,1-bromomethyl-2,3-dichloro,benzene, 1-bromomethyl-2,3-dichloro,acmc-209m1b |
| IUPAC Name | 1-(bromomethyl)-2,3-dichlorobenzene |
| InChI Key | PVIGUZZDWGININ-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrCl2 |
2-Biphenylmethanol, 98%
CAS: 2928-43-0 Molecular Formula: C13H12O Molecular Weight (g/mol): 184.238 MDL Number: MFCD00004620 InChI Key: VKTQADPEPIVMHK-UHFFFAOYSA-N Synonym: 2-biphenylmethanol,1,1'-biphenyl-2-ylmethanol,2-phenylphenyl methanol,biphenylmethanol,2-phenylbenzyl alcohol,1,1'-biphenyl methanol,biphenyl-2-yl-methanol,2-phenylphenyl methan-1-ol,1,1'-biphenyl-2-methanol,biphenyl-2-ylmethanol PubChem CID: 76229 IUPAC Name: (2-phenylphenyl)methanol SMILES: C1=CC=C(C=C1)C2=CC=CC=C2CO
| PubChem CID | 76229 |
|---|---|
| CAS | 2928-43-0 |
| Molecular Weight (g/mol) | 184.238 |
| MDL Number | MFCD00004620 |
| SMILES | C1=CC=C(C=C1)C2=CC=CC=C2CO |
| Synonym | 2-biphenylmethanol,1,1'-biphenyl-2-ylmethanol,2-phenylphenyl methanol,biphenylmethanol,2-phenylbenzyl alcohol,1,1'-biphenyl methanol,biphenyl-2-yl-methanol,2-phenylphenyl methan-1-ol,1,1'-biphenyl-2-methanol,biphenyl-2-ylmethanol |
| IUPAC Name | (2-phenylphenyl)methanol |
| InChI Key | VKTQADPEPIVMHK-UHFFFAOYSA-N |
| Molecular Formula | C13H12O |
3-(Chloromethyl)benzoic acid, 97%, Thermo Scientific Chemicals
CAS: 31719-77-4 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00191922 InChI Key: PBSUMBYSVFTMNG-UHFFFAOYSA-N Synonym: 3-chloromethyl benzoic acid,alpha-chloro-m-toluic acid,3-chloromethyl-benzoic acid,benzoic acid, 3-chloromethyl,pubchem7446,acmc-209hog,3-carboxybenzyl chloride,3-chloromethyl benzoicacid,ksc497k4l,chembl67150 PubChem CID: 241752 IUPAC Name: 3-(chloromethyl)benzoic acid SMILES: OC(=O)C1=CC=CC(CCl)=C1
| PubChem CID | 241752 |
|---|---|
| CAS | 31719-77-4 |
| Molecular Weight (g/mol) | 170.59 |
| MDL Number | MFCD00191922 |
| SMILES | OC(=O)C1=CC=CC(CCl)=C1 |
| Synonym | 3-chloromethyl benzoic acid,alpha-chloro-m-toluic acid,3-chloromethyl-benzoic acid,benzoic acid, 3-chloromethyl,pubchem7446,acmc-209hog,3-carboxybenzyl chloride,3-chloromethyl benzoicacid,ksc497k4l,chembl67150 |
| IUPAC Name | 3-(chloromethyl)benzoic acid |
| InChI Key | PBSUMBYSVFTMNG-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO2 |
(3,4-Dimethoxyphenyl)acetonitrile, 99+%
CAS: 93-17-4 Molecular Formula: C10H11NO2 Molecular Weight (g/mol): 177.2 MDL Number: MFCD00001911 InChI Key: ASLSUMISAQDOOB-UHFFFAOYSA-N Synonym: 3,4-dimethoxyphenylacetonitrile,3,4-dimethoxyphenyl acetonitrile,homoveratronitrile,3,4-dimethoxybenzyl cyanide,veratryl cyanide,2-3,4-dimethoxyphenyl acetonitrile,3,4-dimethoxybenzeneacetonitrile,benzeneacetonitrile, 3,4-dimethoxy,unii-62c8s706sp,3,4-dimethoxy phenylacetonitrile PubChem CID: 66727 IUPAC Name: 2-(3,4-dimethoxyphenyl)acetonitrile SMILES: COC1=C(C=C(C=C1)CC#N)OC
| PubChem CID | 66727 |
|---|---|
| CAS | 93-17-4 |
| Molecular Weight (g/mol) | 177.2 |
| MDL Number | MFCD00001911 |
| SMILES | COC1=C(C=C(C=C1)CC#N)OC |
| Synonym | 3,4-dimethoxyphenylacetonitrile,3,4-dimethoxyphenyl acetonitrile,homoveratronitrile,3,4-dimethoxybenzyl cyanide,veratryl cyanide,2-3,4-dimethoxyphenyl acetonitrile,3,4-dimethoxybenzeneacetonitrile,benzeneacetonitrile, 3,4-dimethoxy,unii-62c8s706sp,3,4-dimethoxy phenylacetonitrile |
| IUPAC Name | 2-(3,4-dimethoxyphenyl)acetonitrile |
| InChI Key | ASLSUMISAQDOOB-UHFFFAOYSA-N |
| Molecular Formula | C10H11NO2 |
5-Bromo-2-hydroxybenzyl alcohol, 98%
CAS: 2316-64-5 Molecular Formula: C7H7BrO2 Molecular Weight (g/mol): 203.04 MDL Number: MFCD00004618 InChI Key: KNKRHSVKIORZQB-UHFFFAOYSA-N Synonym: 5-bromo-2-hydroxybenzyl alcohol,4-bromo-2-hydroxymethyl phenol,bromosaligenin,5-bromosalicyl alcohol,bromsalizol,5-bromosaligenin,5-bromo-2-hydroxybenzylalcohol,2-hydroxymethyl-4-bromophenol,benzenemethanol, 5-bromo-2-hydroxy,unii-y1uz53815e PubChem CID: 75342 IUPAC Name: 4-bromo-2-(hydroxymethyl)phenol SMILES: OCC1=CC(Br)=CC=C1O
| PubChem CID | 75342 |
|---|---|
| CAS | 2316-64-5 |
| Molecular Weight (g/mol) | 203.04 |
| MDL Number | MFCD00004618 |
| SMILES | OCC1=CC(Br)=CC=C1O |
| Synonym | 5-bromo-2-hydroxybenzyl alcohol,4-bromo-2-hydroxymethyl phenol,bromosaligenin,5-bromosalicyl alcohol,bromsalizol,5-bromosaligenin,5-bromo-2-hydroxybenzylalcohol,2-hydroxymethyl-4-bromophenol,benzenemethanol, 5-bromo-2-hydroxy,unii-y1uz53815e |
| IUPAC Name | 4-bromo-2-(hydroxymethyl)phenol |
| InChI Key | KNKRHSVKIORZQB-UHFFFAOYSA-N |
| Molecular Formula | C7H7BrO2 |
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 |
2,6-Difluorobenzyl bromide, 96%
CAS: 85118-00-9 Molecular Formula: C7H5BrF2 Molecular Weight (g/mol): 207.02 MDL Number: MFCD00000329 InChI Key: LSXJPJGBWSZHTM-UHFFFAOYSA-N Synonym: 2,6-difluorobenzyl bromide,2-bromomethyl-1,3-difluorobenzene,2,6-difluorobenzylbromide,alpha-bromo-2,6-difluorotoluene,benzene, 2-bromomethyl-1,3-difluoro,timtec-bb sbb006564,2-bromomethyl-1,3-difluoro-benzene,fr cf b1e,pubchem4915,acmc-209q4j PubChem CID: 581435 IUPAC Name: 2-(bromomethyl)-1,3-difluorobenzene SMILES: FC1=CC=CC(F)=C1CBr
| PubChem CID | 581435 |
|---|---|
| CAS | 85118-00-9 |
| Molecular Weight (g/mol) | 207.02 |
| MDL Number | MFCD00000329 |
| SMILES | FC1=CC=CC(F)=C1CBr |
| Synonym | 2,6-difluorobenzyl bromide,2-bromomethyl-1,3-difluorobenzene,2,6-difluorobenzylbromide,alpha-bromo-2,6-difluorotoluene,benzene, 2-bromomethyl-1,3-difluoro,timtec-bb sbb006564,2-bromomethyl-1,3-difluoro-benzene,fr cf b1e,pubchem4915,acmc-209q4j |
| IUPAC Name | 2-(bromomethyl)-1,3-difluorobenzene |
| InChI Key | LSXJPJGBWSZHTM-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrF2 |
3-Fluoro-4-nitrobenzyl bromide, 97%
CAS: 131858-37-2 Molecular Formula: C7H5BrFNO2 Molecular Weight (g/mol): 234.02 MDL Number: MFCD03094237 InChI Key: ZOZJSWIXPIVMRU-UHFFFAOYSA-N Synonym: 3-fluoro-4-nitrobenzyl bromide,4-bromomethyl-2-fluoro-1-nitrobenzene,4-bromomethyl-2-fluoronitrobenzene,benzene, 4-bromomethyl-2-fluoro-1-nitro,intermediates-zcf02012,acmc-1c6h7,4-bromomethyl-2-fluoro-1-nitro-benzene,benzene,4-bromomethyl-2-fluoro-1-nitro,4-bromomethyl-2-fluoranyl-1-nitro-benzene PubChem CID: 2774661 IUPAC Name: 4-(bromomethyl)-2-fluoro-1-nitrobenzene SMILES: [O-][N+](=O)C1=C(F)C=C(CBr)C=C1
| PubChem CID | 2774661 |
|---|---|
| CAS | 131858-37-2 |
| Molecular Weight (g/mol) | 234.02 |
| MDL Number | MFCD03094237 |
| SMILES | [O-][N+](=O)C1=C(F)C=C(CBr)C=C1 |
| Synonym | 3-fluoro-4-nitrobenzyl bromide,4-bromomethyl-2-fluoro-1-nitrobenzene,4-bromomethyl-2-fluoronitrobenzene,benzene, 4-bromomethyl-2-fluoro-1-nitro,intermediates-zcf02012,acmc-1c6h7,4-bromomethyl-2-fluoro-1-nitro-benzene,benzene,4-bromomethyl-2-fluoro-1-nitro,4-bromomethyl-2-fluoranyl-1-nitro-benzene |
| IUPAC Name | 4-(bromomethyl)-2-fluoro-1-nitrobenzene |
| InChI Key | ZOZJSWIXPIVMRU-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrFNO2 |