Benzene and substituted derivatives
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Bisphenol A diglycidyl ether resin
CAS: 1675-54-3 Molecular Formula: C21H24O4 Molecular Weight (g/mol): 340.419 MDL Number: MFCD00080480 InChI Key: LCFVJGUPQDGYKZ-UHFFFAOYSA-N Synonym: bisphenol a diglycidyl ether,2,2-bis 4-glycidyloxyphenyl propane,epoxide a,epophen el 5,badge,dian diglycidyl ether,diglycidyl bisphenol a,epi-rez 510,bpdge,dgeba PubChem CID: 2286 ChEBI: CHEBI:34578 IUPAC Name: 2-[[4-[2-[4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenoxy]methyl]oxirane SMILES: CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4
| PubChem CID | 2286 |
|---|---|
| CAS | 1675-54-3 |
| Molecular Weight (g/mol) | 340.419 |
| ChEBI | CHEBI:34578 |
| MDL Number | MFCD00080480 |
| SMILES | CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4 |
| Synonym | bisphenol a diglycidyl ether,2,2-bis 4-glycidyloxyphenyl propane,epoxide a,epophen el 5,badge,dian diglycidyl ether,diglycidyl bisphenol a,epi-rez 510,bpdge,dgeba |
| IUPAC Name | 2-[[4-[2-[4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenoxy]methyl]oxirane |
| InChI Key | LCFVJGUPQDGYKZ-UHFFFAOYSA-N |
| Molecular Formula | C21H24O4 |
Isobutyl 4-hydroxybenzoate, 98%
CAS: 2-3-4247 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00020167 InChI Key: XPJVKCRENWUEJH-UHFFFAOYSA-N Synonym: isobutyl 4-hydroxybenzoate,isobutylparaben,isobutyl p-hydroxybenzoate,isobutyl paraben,isobutyl-4-hydroxybenzoate,isobutyl parahydroxybenzoate,4-hydroxybenzoic acid isobutyl ester,benzoic acid, 4-hydroxy-, 2-methylpropyl ester,p-oxybenzoesaureisobutylester,unii-0qqj25x58g PubChem CID: 20240 IUPAC Name: 2-methylpropyl 4-hydroxybenzoate SMILES: CC(C)COC(=O)C1=CC=C(C=C1)O
| PubChem CID | 20240 |
|---|---|
| CAS | 2-3-4247 |
| Molecular Weight (g/mol) | 194.23 |
| MDL Number | MFCD00020167 |
| SMILES | CC(C)COC(=O)C1=CC=C(C=C1)O |
| Synonym | isobutyl 4-hydroxybenzoate,isobutylparaben,isobutyl p-hydroxybenzoate,isobutyl paraben,isobutyl-4-hydroxybenzoate,isobutyl parahydroxybenzoate,4-hydroxybenzoic acid isobutyl ester,benzoic acid, 4-hydroxy-, 2-methylpropyl ester,p-oxybenzoesaureisobutylester,unii-0qqj25x58g |
| IUPAC Name | 2-methylpropyl 4-hydroxybenzoate |
| InChI Key | XPJVKCRENWUEJH-UHFFFAOYSA-N |
| Molecular Formula | C11H14O3 |
4-Ethylbenzaldehyde, 97%
CAS: 4748-78-1 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.178 MDL Number: MFCD00006956 InChI Key: QNGNSVIICDLXHT-UHFFFAOYSA-N Synonym: p-ethylbenzaldehyde,benzaldehyde, 4-ethyl,4-ethyl benzaldehyde,4-ethyl-benzaldehyde,ebal,ethyl benzaldehyde,ethyl-benzaldehyde,unii-289ppw3sg4,benzaldehyde,4-ethyl,ethylbenzaldehyde, p PubChem CID: 20861 IUPAC Name: 4-ethylbenzaldehyde SMILES: CCC1=CC=C(C=C1)C=O
| PubChem CID | 20861 |
|---|---|
| CAS | 4748-78-1 |
| Molecular Weight (g/mol) | 134.178 |
| MDL Number | MFCD00006956 |
| SMILES | CCC1=CC=C(C=C1)C=O |
| Synonym | p-ethylbenzaldehyde,benzaldehyde, 4-ethyl,4-ethyl benzaldehyde,4-ethyl-benzaldehyde,ebal,ethyl benzaldehyde,ethyl-benzaldehyde,unii-289ppw3sg4,benzaldehyde,4-ethyl,ethylbenzaldehyde, p |
| IUPAC Name | 4-ethylbenzaldehyde |
| InChI Key | QNGNSVIICDLXHT-UHFFFAOYSA-N |
| Molecular Formula | C9H10O |
2-Phenylpropionaldehyde, 97%
CAS: 93-53-8 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.178 MDL Number: MFCD00006973 InChI Key: IQVAERDLDAZARL-UHFFFAOYSA-N Synonym: 2-phenylpropionaldehyde,hydratropaldehyde,hydratropic aldehyde,hyacinthal,cumene aldehyde,hydratropa aldehyde,hydrotropic aldehyde,2-phenyl-1-propanal,2-phenyl propionaldehyde,aldehyd hydratropovy PubChem CID: 7146 IUPAC Name: 2-phenylpropanal SMILES: CC(C=O)C1=CC=CC=C1
| PubChem CID | 7146 |
|---|---|
| CAS | 93-53-8 |
| Molecular Weight (g/mol) | 134.178 |
| MDL Number | MFCD00006973 |
| SMILES | CC(C=O)C1=CC=CC=C1 |
| Synonym | 2-phenylpropionaldehyde,hydratropaldehyde,hydratropic aldehyde,hyacinthal,cumene aldehyde,hydratropa aldehyde,hydrotropic aldehyde,2-phenyl-1-propanal,2-phenyl propionaldehyde,aldehyd hydratropovy |
| IUPAC Name | 2-phenylpropanal |
| InChI Key | IQVAERDLDAZARL-UHFFFAOYSA-N |
| Molecular Formula | C9H10O |
2-Isopropylphenol, 98+%
CAS: 88-69-7 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00002224 InChI Key: CRBJBYGJVIBWIY-UHFFFAOYSA-N Synonym: 2-isopropylphenol,o-hydroxycumene,o-isopropylphenol,o-cumenol,1-hydroxy-2-isopropylbenzene,2-propan-2-yl phenol,2-1-methylethyl phenol,phenol, o-isopropyl,phenol, 2-1-methylethyl,isopropylphenol PubChem CID: 6943 ChEBI: CHEBI:38506 IUPAC Name: 2-propan-2-ylphenol SMILES: CC(C)C1=CC=CC=C1O
| PubChem CID | 6943 |
|---|---|
| CAS | 88-69-7 |
| Molecular Weight (g/mol) | 136.194 |
| ChEBI | CHEBI:38506 |
| MDL Number | MFCD00002224 |
| SMILES | CC(C)C1=CC=CC=C1O |
| Synonym | 2-isopropylphenol,o-hydroxycumene,o-isopropylphenol,o-cumenol,1-hydroxy-2-isopropylbenzene,2-propan-2-yl phenol,2-1-methylethyl phenol,phenol, o-isopropyl,phenol, 2-1-methylethyl,isopropylphenol |
| IUPAC Name | 2-propan-2-ylphenol |
| InChI Key | CRBJBYGJVIBWIY-UHFFFAOYSA-N |
| Molecular Formula | C9H12O |
3,5-Di-tert-butyl-4-hydroxybenzyl alcohol, 97%
CAS: 88-26-6 Molecular Formula: C15H24O2 Molecular Weight (g/mol): 236.355 MDL Number: MFCD00017254 InChI Key: HNURKXXMYARGAY-UHFFFAOYSA-N Synonym: 3,5-di-tert-butyl-4-hydroxybenzyl alcohol,2,6-di-tert-butyl-4-hydroxymethyl phenol,2,6-di-tert-butyl-4-hydroxymethylphenol,bht alcohol,antioxidant 754,ionox 100,ionox 100 antioxidant,3,5-di-t-butyl-4-hydroxybenzyl alcohol,butylated hydroxymethylphenol,2,6-di-t-butyl-4-hydroxymethylphenol PubChem CID: 6929 IUPAC Name: 2,6-ditert-butyl-4-(hydroxymethyl)phenol SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CO
| PubChem CID | 6929 |
|---|---|
| CAS | 88-26-6 |
| Molecular Weight (g/mol) | 236.355 |
| MDL Number | MFCD00017254 |
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CO |
| Synonym | 3,5-di-tert-butyl-4-hydroxybenzyl alcohol,2,6-di-tert-butyl-4-hydroxymethyl phenol,2,6-di-tert-butyl-4-hydroxymethylphenol,bht alcohol,antioxidant 754,ionox 100,ionox 100 antioxidant,3,5-di-t-butyl-4-hydroxybenzyl alcohol,butylated hydroxymethylphenol,2,6-di-t-butyl-4-hydroxymethylphenol |
| IUPAC Name | 2,6-ditert-butyl-4-(hydroxymethyl)phenol |
| InChI Key | HNURKXXMYARGAY-UHFFFAOYSA-N |
| Molecular Formula | C15H24O2 |
Styrene (stabilized with TBC) 99.0+%, TCI America™
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CAS: 100-42-5 Molecular Formula: C8H8 Molecular Weight (g/mol): 104.15 MDL Number: MFCD00008612,MFCD00084450 InChI Key: PPBRXRYQALVLMV-UHFFFAOYSA-N Synonym: ethenylbenzene,phenylethylene,vinylbenzene,styrol,benzene, ethenyl,cinnamene,phenylethene,monomer,phenethylene,styrolene PubChem CID: 7501 ChEBI: CHEBI:27452 IUPAC Name: ethenylbenzene SMILES: C=CC1=CC=CC=C1
| PubChem CID | 7501 |
|---|---|
| CAS | 100-42-5 |
| Molecular Weight (g/mol) | 104.15 |
| ChEBI | CHEBI:27452 |
| MDL Number | MFCD00008612,MFCD00084450 |
| SMILES | C=CC1=CC=CC=C1 |
| Synonym | ethenylbenzene,phenylethylene,vinylbenzene,styrol,benzene, ethenyl,cinnamene,phenylethene,monomer,phenethylene,styrolene |
| IUPAC Name | ethenylbenzene |
| InChI Key | PPBRXRYQALVLMV-UHFFFAOYSA-N |
| Molecular Formula | C8H8 |
(S)-(-)-1-(4-Fluorophenyl)ethyl isocyanate, 95%
CAS: 745783-74-8 Molecular Formula: C9H8FNO Molecular Weight (g/mol): 165.167 MDL Number: MFCD05664076 InChI Key: MUHCZVYPBWOTTJ-ZETCQYMHSA-N Synonym: s---1-4-fluorophenyl ethyl isocyanate,1-fluoro-4-1s-1-isocyanatoethyl benzene,benzene, 1-fluoro-4-1s-1-isocyanatoethyl-9ci PubChem CID: 7018264 IUPAC Name: 1-fluoro-4-[(1S)-1-isocyanatoethyl]benzene SMILES: CC(C1=CC=C(C=C1)F)N=C=O
| PubChem CID | 7018264 |
|---|---|
| CAS | 745783-74-8 |
| Molecular Weight (g/mol) | 165.167 |
| MDL Number | MFCD05664076 |
| SMILES | CC(C1=CC=C(C=C1)F)N=C=O |
| Synonym | s---1-4-fluorophenyl ethyl isocyanate,1-fluoro-4-1s-1-isocyanatoethyl benzene,benzene, 1-fluoro-4-1s-1-isocyanatoethyl-9ci |
| IUPAC Name | 1-fluoro-4-[(1S)-1-isocyanatoethyl]benzene |
| InChI Key | MUHCZVYPBWOTTJ-ZETCQYMHSA-N |
| Molecular Formula | C9H8FNO |
4-Nitrobenzaldehyde, 99%
CAS: 555-16-8 Molecular Formula: C7H5NO3 Molecular Weight (g/mol): 151.12 MDL Number: MFCD00007346 InChI Key: BXRFQSNOROATLV-UHFFFAOYSA-N Synonym: p-nitrobenzaldehyde,benzaldehyde, 4-nitro,p-formylnitrobenzene,benzaldehyde, p-nitro,4-nitrobenzaldehydde,4-nitro-benzaldehyde,4-formylnitrobenzene,p-nitro benzaldehyde,4-nitro benzaldehyde,ccris 1675 PubChem CID: 541 ChEBI: CHEBI:66926 IUPAC Name: 4-nitrobenzaldehyde SMILES: [O-][N+](=O)C1=CC=C(C=O)C=C1
| PubChem CID | 541 |
|---|---|
| CAS | 555-16-8 |
| Molecular Weight (g/mol) | 151.12 |
| ChEBI | CHEBI:66926 |
| MDL Number | MFCD00007346 |
| SMILES | [O-][N+](=O)C1=CC=C(C=O)C=C1 |
| Synonym | p-nitrobenzaldehyde,benzaldehyde, 4-nitro,p-formylnitrobenzene,benzaldehyde, p-nitro,4-nitrobenzaldehydde,4-nitro-benzaldehyde,4-formylnitrobenzene,p-nitro benzaldehyde,4-nitro benzaldehyde,ccris 1675 |
| IUPAC Name | 4-nitrobenzaldehyde |
| InChI Key | BXRFQSNOROATLV-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO3 |
1,3-Dimethoxybenzene, 99%
CAS: 151-10-0 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00008384 InChI Key: DPZNOMCNRMUKPS-UHFFFAOYSA-N Synonym: m-dimethoxybenzene,resorcinol dimethyl ether,benzene, 1,3-dimethoxy,3-methoxyanisole,benzene, m-dimethoxy,dimethyl resorcinol,m-methoxyanisole,dimethylresorcinol,methoxyanisole, m,dimethylether resorcinolu PubChem CID: 9025 IUPAC Name: 1,3-dimethoxybenzene SMILES: COC1=CC(OC)=CC=C1
| PubChem CID | 9025 |
|---|---|
| CAS | 151-10-0 |
| Molecular Weight (g/mol) | 138.17 |
| MDL Number | MFCD00008384 |
| SMILES | COC1=CC(OC)=CC=C1 |
| Synonym | m-dimethoxybenzene,resorcinol dimethyl ether,benzene, 1,3-dimethoxy,3-methoxyanisole,benzene, m-dimethoxy,dimethyl resorcinol,m-methoxyanisole,dimethylresorcinol,methoxyanisole, m,dimethylether resorcinolu |
| IUPAC Name | 1,3-dimethoxybenzene |
| InChI Key | DPZNOMCNRMUKPS-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |
Pterostilbene 98.0+%, TCI America™
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CAS: 537-42-8 Molecular Formula: C16H16O3 Molecular Weight (g/mol): 256.301 MDL Number: MFCD00238710 InChI Key: VLEUZFDZJKSGMX-ONEGZZNKSA-N Synonym: 4′C-Hydroxy-3,5-dimethoxy-trans-stilbene, trans-1-(3,5-Dimethoxyphenyl)-2-(4-hydroxyphenyl)ethylene PubChem CID: 5281727 ChEBI: CHEBI:8630 IUPAC Name: 4-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]phenol SMILES: COC1=CC(=CC(=C1)C=CC2=CC=C(C=C2)O)OC
| PubChem CID | 5281727 |
|---|---|
| CAS | 537-42-8 |
| Molecular Weight (g/mol) | 256.301 |
| ChEBI | CHEBI:8630 |
| MDL Number | MFCD00238710 |
| SMILES | COC1=CC(=CC(=C1)C=CC2=CC=C(C=C2)O)OC |
| Synonym | 4′C-Hydroxy-3,5-dimethoxy-trans-stilbene, trans-1-(3,5-Dimethoxyphenyl)-2-(4-hydroxyphenyl)ethylene |
| IUPAC Name | 4-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]phenol |
| InChI Key | VLEUZFDZJKSGMX-ONEGZZNKSA-N |
| Molecular Formula | C16H16O3 |
Cinnamoyl Chloride 97.0+%, TCI America™
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CAS: 17082-09-6 Molecular Formula: C9H7ClO Molecular Weight (g/mol): 166.60 MDL Number: MFCD00000732 InChI Key: WOGITNXCNOTRLK-VOTSOKGWSA-N Synonym: cinnamoyl chloride,cinnamic acid chloride,cinnamic chloride,trans-3-phenylacryloyl chloride,2-propenoyl chloride, 3-phenyl,cinnamoylchloride,e-cinnamoyl chloride,trans-cinnamoyl chloride,2e-3-phenylprop-2-enoyl chloride,3-phenyl-2-propenoyl chloride PubChem CID: 5354261 IUPAC Name: (2E)-3-phenylprop-2-enoyl chloride SMILES: ClC(=O)\C=C\C1=CC=CC=C1
| PubChem CID | 5354261 |
|---|---|
| CAS | 17082-09-6 |
| Molecular Weight (g/mol) | 166.60 |
| MDL Number | MFCD00000732 |
| SMILES | ClC(=O)\C=C\C1=CC=CC=C1 |
| Synonym | cinnamoyl chloride,cinnamic acid chloride,cinnamic chloride,trans-3-phenylacryloyl chloride,2-propenoyl chloride, 3-phenyl,cinnamoylchloride,e-cinnamoyl chloride,trans-cinnamoyl chloride,2e-3-phenylprop-2-enoyl chloride,3-phenyl-2-propenoyl chloride |
| IUPAC Name | (2E)-3-phenylprop-2-enoyl chloride |
| InChI Key | WOGITNXCNOTRLK-VOTSOKGWSA-N |
| Molecular Formula | C9H7ClO |
| CAS | 11-8-4940 |
|---|---|
| Molecular Weight (g/mol) | 140.14 |
| Molecular Formula | C7H8O3 |
Ethyl 4-hydroxybenzoate, 99%
CAS: 120-47-8 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00002353 InChI Key: NUVBSKCKDOMJSU-UHFFFAOYSA-N Synonym: ethylparaben,ethyl paraben,ethyl p-hydroxybenzoate,mycocten,ethyl parasept,4-hydroxybenzoic acid ethyl ester,easeptol,ethyl butex,ethyl parahydroxybenzoate,tegosept e PubChem CID: 8434 ChEBI: CHEBI:86616 IUPAC Name: ethyl 4-hydroxybenzoate SMILES: CCOC(=O)C1=CC=C(C=C1)O
| PubChem CID | 8434 |
|---|---|
| CAS | 120-47-8 |
| Molecular Weight (g/mol) | 166.18 |
| ChEBI | CHEBI:86616 |
| MDL Number | MFCD00002353 |
| SMILES | CCOC(=O)C1=CC=C(C=C1)O |
| Synonym | ethylparaben,ethyl paraben,ethyl p-hydroxybenzoate,mycocten,ethyl parasept,4-hydroxybenzoic acid ethyl ester,easeptol,ethyl butex,ethyl parahydroxybenzoate,tegosept e |
| IUPAC Name | ethyl 4-hydroxybenzoate |
| InChI Key | NUVBSKCKDOMJSU-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
4-Chlorobenzyl chloride, 99+%
CAS: 104-83-6 Molecular Formula: C7H6Cl2 Molecular Weight (g/mol): 161.03 MDL Number: MFCD00000914 InChI Key: JQZAEUFPPSRDOP-UHFFFAOYSA-N Synonym: 4-chlorobenzyl chloride,1-chloro-4-chloromethyl benzene,p-chlorobenzyl chloride,benzene, 1-chloro-4-chloromethyl,alpha,4-dichlorotoluene,4-chlorobenzylchloride,4-chlorophenyl methyl chloride,1-chloro-4-chloromethyl-benzene,alpha,p-dichlorotoluene,toluene, p,alpha-dichloro PubChem CID: 7723 IUPAC Name: 1-chloro-4-(chloromethyl)benzene SMILES: C1=CC(=CC=C1CCl)Cl
| PubChem CID | 7723 |
|---|---|
| CAS | 104-83-6 |
| Molecular Weight (g/mol) | 161.03 |
| MDL Number | MFCD00000914 |
| SMILES | C1=CC(=CC=C1CCl)Cl |
| Synonym | 4-chlorobenzyl chloride,1-chloro-4-chloromethyl benzene,p-chlorobenzyl chloride,benzene, 1-chloro-4-chloromethyl,alpha,4-dichlorotoluene,4-chlorobenzylchloride,4-chlorophenyl methyl chloride,1-chloro-4-chloromethyl-benzene,alpha,p-dichlorotoluene,toluene, p,alpha-dichloro |
| IUPAC Name | 1-chloro-4-(chloromethyl)benzene |
| InChI Key | JQZAEUFPPSRDOP-UHFFFAOYSA-N |
| Molecular Formula | C7H6Cl2 |