Benzene and substituted derivatives
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[4-(1H-1,2,4-Triazol-1-ylmethyl)phenyl]methanol, ≥97%, Thermo Scientific™
CAS: 160388-56-7 Molecular Formula: C10H11N3O Molecular Weight (g/mol): 189.218 MDL Number: MFCD07772869 InChI Key: XEOWXPICRQBFIT-UHFFFAOYSA-N Synonym: 4-1h-1,2,4-triazol-1-ylmethyl phenyl methanol,4-1,2,4-triazol-1-ylmethyl phenyl methanol,4-1h-1,2,4-triazol-1-ylmethyl benzyl alcohol,4-1,2,4-triazolylmethyl phenyl methan-1-ol,4-1h-1,2,4-triazol-1-yl methyl phenyl methanol PubChem CID: 7162035 IUPAC Name: [4-(1,2,4-triazol-1-ylmethyl)phenyl]methanol SMILES: C1=CC(=CC=C1CN2C=NC=N2)CO
| PubChem CID | 7162035 |
|---|---|
| CAS | 160388-56-7 |
| Molecular Weight (g/mol) | 189.218 |
| MDL Number | MFCD07772869 |
| SMILES | C1=CC(=CC=C1CN2C=NC=N2)CO |
| Synonym | 4-1h-1,2,4-triazol-1-ylmethyl phenyl methanol,4-1,2,4-triazol-1-ylmethyl phenyl methanol,4-1h-1,2,4-triazol-1-ylmethyl benzyl alcohol,4-1,2,4-triazolylmethyl phenyl methan-1-ol,4-1h-1,2,4-triazol-1-yl methyl phenyl methanol |
| IUPAC Name | [4-(1,2,4-triazol-1-ylmethyl)phenyl]methanol |
| InChI Key | XEOWXPICRQBFIT-UHFFFAOYSA-N |
| Molecular Formula | C10H11N3O |
[2-(2-Furyl)phenyl]methanol, ≥97%, Thermo Scientific™
CAS: 139697-88-4 Molecular Formula: C11H10O2 Molecular Weight (g/mol): 174.20 MDL Number: MFCD06203101 InChI Key: NBLMKRIYULDNBF-UHFFFAOYSA-N Synonym: 2-2-furyl phenyl methanol,2-furan-2-yl phenyl methanol,2-fur-2-yl benzyl alcohol,2-2-furyl benzenemethanol,2-fur-2-yl phenyl methanol,benzenemethanol,2-2-furanyl,2-2-furyl phenyl methan-1-ol PubChem CID: 10855985 IUPAC Name: [2-(furan-2-yl)phenyl]methanol SMILES: OCC1=CC=CC=C1C1=CC=CO1
| PubChem CID | 10855985 |
|---|---|
| CAS | 139697-88-4 |
| Molecular Weight (g/mol) | 174.20 |
| MDL Number | MFCD06203101 |
| SMILES | OCC1=CC=CC=C1C1=CC=CO1 |
| Synonym | 2-2-furyl phenyl methanol,2-furan-2-yl phenyl methanol,2-fur-2-yl benzyl alcohol,2-2-furyl benzenemethanol,2-fur-2-yl phenyl methanol,benzenemethanol,2-2-furanyl,2-2-furyl phenyl methan-1-ol |
| IUPAC Name | [2-(furan-2-yl)phenyl]methanol |
| InChI Key | NBLMKRIYULDNBF-UHFFFAOYSA-N |
| Molecular Formula | C11H10O2 |
4-(Hydroxymethyl)benzoic acid, 98+%
CAS: 3006-96-0 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00017598 InChI Key: WWYFPDXEIFBNKE-UHFFFAOYSA-N Synonym: 4-hydroxymethyl benzoic acid,4-hydroxythylbenzoic acid,unii-9z28l8sthd,hmba linker,4-hydroxymethyl-benzoic acid,benzoic acid, 4-hydroxymethyl,p-hydroxymethyl benzoic acid,4-hydroxymethyl benzoicacid,9z28l8sthd PubChem CID: 76360 IUPAC Name: 4-(hydroxymethyl)benzoic acid SMILES: OCC1=CC=C(C=C1)C(O)=O
| PubChem CID | 76360 |
|---|---|
| CAS | 3006-96-0 |
| Molecular Weight (g/mol) | 152.15 |
| MDL Number | MFCD00017598 |
| SMILES | OCC1=CC=C(C=C1)C(O)=O |
| Synonym | 4-hydroxymethyl benzoic acid,4-hydroxythylbenzoic acid,unii-9z28l8sthd,hmba linker,4-hydroxymethyl-benzoic acid,benzoic acid, 4-hydroxymethyl,p-hydroxymethyl benzoic acid,4-hydroxymethyl benzoicacid,9z28l8sthd |
| IUPAC Name | 4-(hydroxymethyl)benzoic acid |
| InChI Key | WWYFPDXEIFBNKE-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
alpha-Bromo-4-nitro-o-cresol, 95%
CAS: 772-33-8 MDL Number: MFCD00007340 InChI Key: KFDPCYZHENQOBV-UHFFFAOYSA-N Synonym: 2-hydroxy-5-nitrobenzyl bromide,2-bromomethyl-4-nitrophenol,alpha-bromo-4-nitro-o-cresol,phenol, 2-bromomethyl-4-nitro,koshland reagent i,2-bromomethyl-4-nitro-phenol,2-hydroxy-5-nitrobenzylbromide,.alpha.-bromo-4-nitro-o-cresol,o-cresol, .alpha.-bromo-4-nitro,koshland i PubChem CID: 13044 IUPAC Name: 2-(bromomethyl)-4-nitrophenol SMILES: C1=CC(=C(C=C1[N+](=O)[O-])CBr)O
| PubChem CID | 13044 |
|---|---|
| CAS | 772-33-8 |
| MDL Number | MFCD00007340 |
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])CBr)O |
| Synonym | 2-hydroxy-5-nitrobenzyl bromide,2-bromomethyl-4-nitrophenol,alpha-bromo-4-nitro-o-cresol,phenol, 2-bromomethyl-4-nitro,koshland reagent i,2-bromomethyl-4-nitro-phenol,2-hydroxy-5-nitrobenzylbromide,.alpha.-bromo-4-nitro-o-cresol,o-cresol, .alpha.-bromo-4-nitro,koshland i |
| IUPAC Name | 2-(bromomethyl)-4-nitrophenol |
| InChI Key | KFDPCYZHENQOBV-UHFFFAOYSA-N |
(S)-(+)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetyl chloride, 98+%
CAS: 20445-33-4 Molecular Formula: C10H8ClF3O2 Molecular Weight (g/mol): 252.617 MDL Number: MFCD00067105 InChI Key: PAORVUMOXXAMPL-SECBINFHSA-N Synonym: s-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,+-mtpa-cl,unii-472va70ul4,2s-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,s-+-alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,s-+-a-methoxy-a-trifluoromethylphenylacetyl chloride,s-+-alpha-methoxy-alpha-trifluoromethylphenylacetylchloride,s-+-alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,+-mtpa chloride,+-mosher's chloride PubChem CID: 2724611 IUPAC Name: (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride SMILES: COC(C1=CC=CC=C1)(C(=O)Cl)C(F)(F)F
| PubChem CID | 2724611 |
|---|---|
| CAS | 20445-33-4 |
| Molecular Weight (g/mol) | 252.617 |
| MDL Number | MFCD00067105 |
| SMILES | COC(C1=CC=CC=C1)(C(=O)Cl)C(F)(F)F |
| Synonym | s-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,+-mtpa-cl,unii-472va70ul4,2s-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,s-+-alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,s-+-a-methoxy-a-trifluoromethylphenylacetyl chloride,s-+-alpha-methoxy-alpha-trifluoromethylphenylacetylchloride,s-+-alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,+-mtpa chloride,+-mosher's chloride |
| IUPAC Name | (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride |
| InChI Key | PAORVUMOXXAMPL-SECBINFHSA-N |
| Molecular Formula | C10H8ClF3O2 |
4-[4-(Bromomethyl)phenyl]-1,2,3-thiadiazole, 97%, Thermo Scientific™
CAS: 163798-92-3 Molecular Formula: C9H7BrN2S Molecular Weight (g/mol): 255.13 MDL Number: MFCD00052102 InChI Key: DGHQOPZIGDRUIT-UHFFFAOYSA-N Synonym: 4-4-bromomethyl phenyl-1,2,3-thiadiazole,1,2,3-thiadiazole,4-4-bromomethyl phenyl,4-4-bromomethyl phenyl thiadiazole,4-1,2,3-thiadiazol-4-yl benzyl bromide,4-4-bromomethylphenyl-1,2,3-thiadiazole,4-4-bromomethyl-phenyl-1,2,3 thiadiazole PubChem CID: 2776454 IUPAC Name: 4-[4-(bromomethyl)phenyl]thiadiazole SMILES: BrCC1=CC=C(C=C1)C1=CSN=N1
| PubChem CID | 2776454 |
|---|---|
| CAS | 163798-92-3 |
| Molecular Weight (g/mol) | 255.13 |
| MDL Number | MFCD00052102 |
| SMILES | BrCC1=CC=C(C=C1)C1=CSN=N1 |
| Synonym | 4-4-bromomethyl phenyl-1,2,3-thiadiazole,1,2,3-thiadiazole,4-4-bromomethyl phenyl,4-4-bromomethyl phenyl thiadiazole,4-1,2,3-thiadiazol-4-yl benzyl bromide,4-4-bromomethylphenyl-1,2,3-thiadiazole,4-4-bromomethyl-phenyl-1,2,3 thiadiazole |
| IUPAC Name | 4-[4-(bromomethyl)phenyl]thiadiazole |
| InChI Key | DGHQOPZIGDRUIT-UHFFFAOYSA-N |
| Molecular Formula | C9H7BrN2S |
(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 |
(4-Thien-3-ylphenyl)methanol, ≥97%, Thermo Scientific™
CAS: 160278-20-6 Molecular Formula: C11H10OS Molecular Weight (g/mol): 190.26 MDL Number: MFCD06203084 InChI Key: KEHJEXSFOWCTHM-UHFFFAOYSA-N PubChem CID: 15186379 IUPAC Name: (4-thiophen-3-ylphenyl)methanol SMILES: C1=CC(=CC=C1CO)C2=CSC=C2
| PubChem CID | 15186379 |
|---|---|
| CAS | 160278-20-6 |
| Molecular Weight (g/mol) | 190.26 |
| MDL Number | MFCD06203084 |
| SMILES | C1=CC(=CC=C1CO)C2=CSC=C2 |
| IUPAC Name | (4-thiophen-3-ylphenyl)methanol |
| InChI Key | KEHJEXSFOWCTHM-UHFFFAOYSA-N |
| Molecular Formula | C11H10OS |
5-(Hydroxymethyl)-2-iodophenol,97%, Thermo Scientific™
CAS: 773869-57-1 Molecular Formula: C7H7IO2 Molecular Weight (g/mol): 250.035 InChI Key: VIWWSAGABDIIFF-UHFFFAOYSA-N Synonym: 5-hydroxymethyl-2-iodophenol,3-hydroxy-4-iodobenzyl alcohol,3-hydroxy-4-iodobenzenemethanol,benzenemethanol,3-hydroxy-4-iodo,zlchem 794,5-hydroxymethyl-2-iodo-phenol,3-hydroxy-4-iodophenyl methanol,5-hydroxymethyl-2-iodanyl-phenol PubChem CID: 18525941 IUPAC Name: 5-(hydroxymethyl)-2-iodophenol SMILES: C1=CC(=C(C=C1CO)O)I
| PubChem CID | 18525941 |
|---|---|
| CAS | 773869-57-1 |
| Molecular Weight (g/mol) | 250.035 |
| SMILES | C1=CC(=C(C=C1CO)O)I |
| Synonym | 5-hydroxymethyl-2-iodophenol,3-hydroxy-4-iodobenzyl alcohol,3-hydroxy-4-iodobenzenemethanol,benzenemethanol,3-hydroxy-4-iodo,zlchem 794,5-hydroxymethyl-2-iodo-phenol,3-hydroxy-4-iodophenyl methanol,5-hydroxymethyl-2-iodanyl-phenol |
| IUPAC Name | 5-(hydroxymethyl)-2-iodophenol |
| InChI Key | VIWWSAGABDIIFF-UHFFFAOYSA-N |
| Molecular Formula | C7H7IO2 |
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 |
4-Chloro-2-nitrobenzyl chloride, 98%
CAS: 938-71-6 Molecular Formula: C7H5Cl2NO2 Molecular Weight (g/mol): 206.02 MDL Number: MFCD00007216 InChI Key: QBIQAXWMONJLNW-UHFFFAOYSA-N Synonym: 4-chloro-2-nitrobenzyl chloride,4-chloro-1-chloromethyl-2-nitrobenzene,4-chloro-2-nitrobenzylchloride,acmc-20amlj,benzene, 4-chloro-1-chloromethyl-2-nitro,2-nitro-4-chlorobenzyl chloride,omphlgrocarzou-uhfffaoysa,.alpha.,4-dichloro-2-nitrotoluene PubChem CID: 598399 SMILES: [O-][N+](=O)C1=CC(Cl)=CC(CCl)=C1
| PubChem CID | 598399 |
|---|---|
| CAS | 938-71-6 |
| Molecular Weight (g/mol) | 206.02 |
| MDL Number | MFCD00007216 |
| SMILES | [O-][N+](=O)C1=CC(Cl)=CC(CCl)=C1 |
| Synonym | 4-chloro-2-nitrobenzyl chloride,4-chloro-1-chloromethyl-2-nitrobenzene,4-chloro-2-nitrobenzylchloride,acmc-20amlj,benzene, 4-chloro-1-chloromethyl-2-nitro,2-nitro-4-chlorobenzyl chloride,omphlgrocarzou-uhfffaoysa,.alpha.,4-dichloro-2-nitrotoluene |
| InChI Key | QBIQAXWMONJLNW-UHFFFAOYSA-N |
| Molecular Formula | C7H5Cl2NO2 |
Hexadimethrine Bromide, Spectrum™ Chemical
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CAS: 28728-55-4
| CAS | 28728-55-4 |
|---|
4-Chlorobenzyl bromide, 98%
CAS: 622-95-7 Molecular Formula: C7H6BrCl Molecular Weight (g/mol): 205.48 MDL Number: MFCD00040714 InChI Key: KQNBRMUBPRGXSL-UHFFFAOYSA-N Synonym: 4-chlorobenzyl bromide,1-bromomethyl-4-chlorobenzene,p-chlorobenzyl bromide,4-chlorobenzylbromide,benzene, 1-bromomethyl-4-chloro,alpha-bromo-4-chlorotoluene,4cbb,p-chlorobenzylbromide,4-chloro-benzylbromide PubChem CID: 69329 IUPAC Name: 1-(bromomethyl)-4-chlorobenzene SMILES: ClC1=CC=C(CBr)C=C1
| PubChem CID | 69329 |
|---|---|
| CAS | 622-95-7 |
| Molecular Weight (g/mol) | 205.48 |
| MDL Number | MFCD00040714 |
| SMILES | ClC1=CC=C(CBr)C=C1 |
| Synonym | 4-chlorobenzyl bromide,1-bromomethyl-4-chlorobenzene,p-chlorobenzyl bromide,4-chlorobenzylbromide,benzene, 1-bromomethyl-4-chloro,alpha-bromo-4-chlorotoluene,4cbb,p-chlorobenzylbromide,4-chloro-benzylbromide |
| IUPAC Name | 1-(bromomethyl)-4-chlorobenzene |
| InChI Key | KQNBRMUBPRGXSL-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrCl |
4-Bromo-2-fluorobenzyl cyanide, 98+%, Thermo Scientific™
CAS: 114897-91-5 Molecular Formula: C8H5BrFN Molecular Weight (g/mol): 214.04 MDL Number: MFCD07368653 InChI Key: QLASQEZPJFNZQC-UHFFFAOYSA-N Synonym: 4-bromo-2-fluorobenzyl cyanide,2-4-bromo-2-fluorophenyl acetonitrile,4-bromo-2-fluorophenylacetonitrile,2-fluoro-4-bromophenylacetonitrile,benzeneacetonitrile, 4-bromo-2-fluoro,4-bromo-2-fluorophenyl acetonitrile,2-4-bromo-2-fluorophenyl ethanenitrile,4-bromo-2-fluorobenzylcyanide,pubchem10413,acmc-2099lv PubChem CID: 7172308 IUPAC Name: 2-(4-bromo-2-fluorophenyl)acetonitrile SMILES: FC1=CC(Br)=CC=C1CC#N
| PubChem CID | 7172308 |
|---|---|
| CAS | 114897-91-5 |
| Molecular Weight (g/mol) | 214.04 |
| MDL Number | MFCD07368653 |
| SMILES | FC1=CC(Br)=CC=C1CC#N |
| Synonym | 4-bromo-2-fluorobenzyl cyanide,2-4-bromo-2-fluorophenyl acetonitrile,4-bromo-2-fluorophenylacetonitrile,2-fluoro-4-bromophenylacetonitrile,benzeneacetonitrile, 4-bromo-2-fluoro,4-bromo-2-fluorophenyl acetonitrile,2-4-bromo-2-fluorophenyl ethanenitrile,4-bromo-2-fluorobenzylcyanide,pubchem10413,acmc-2099lv |
| IUPAC Name | 2-(4-bromo-2-fluorophenyl)acetonitrile |
| InChI Key | QLASQEZPJFNZQC-UHFFFAOYSA-N |
| Molecular Formula | C8H5BrFN |
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 |