Benzenoids
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p-Tolyl Isobutyrate 97.0+%, TCI America™
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CAS: 103-93-5 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.23 MDL Number: MFCD00026440 InChI Key: UPPSFGGDKACIKP-UHFFFAOYSA-N Synonym: Isobutyric Acid p-Tolyl Ester PubChem CID: 7685 IUPAC Name: 4-methylphenyl 2-methylpropanoate SMILES: CC(C)C(=O)OC1=CC=C(C)C=C1
| PubChem CID | 7685 |
|---|---|
| CAS | 103-93-5 |
| Molecular Weight (g/mol) | 178.23 |
| MDL Number | MFCD00026440 |
| SMILES | CC(C)C(=O)OC1=CC=C(C)C=C1 |
| Synonym | Isobutyric Acid p-Tolyl Ester |
| IUPAC Name | 4-methylphenyl 2-methylpropanoate |
| InChI Key | UPPSFGGDKACIKP-UHFFFAOYSA-N |
| Molecular Formula | C11H14O2 |
2-Methoxyphenethyl Alcohol 98.0+%, TCI America™
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CAS: 7417-18-7 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00002889 InChI Key: XLDRDNQLEMMNNH-UHFFFAOYSA-N Synonym: 2-(2-Hydroxyethyl)anisole, 2-(2-Methoxyphenyl)ethanol PubChem CID: 81909 IUPAC Name: 2-(2-methoxyphenyl)ethan-1-ol SMILES: COC1=CC=CC=C1CCO
| PubChem CID | 81909 |
|---|---|
| CAS | 7417-18-7 |
| Molecular Weight (g/mol) | 152.19 |
| MDL Number | MFCD00002889 |
| SMILES | COC1=CC=CC=C1CCO |
| Synonym | 2-(2-Hydroxyethyl)anisole, 2-(2-Methoxyphenyl)ethanol |
| IUPAC Name | 2-(2-methoxyphenyl)ethan-1-ol |
| InChI Key | XLDRDNQLEMMNNH-UHFFFAOYSA-N |
| Molecular Formula | C9H12O2 |
2-(3-Bromophenyl)-4,6-diphenyl-1,3,5-triazine 97.0+%, TCI America™
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CAS: 864377-31-1 Molecular Formula: C21H14BrN3 Molecular Weight (g/mol): 388.27 MDL Number: MFCD22200060 InChI Key: HNZUKQQNZRMNGS-UHFFFAOYSA-N PubChem CID: 58943302 IUPAC Name: 2-(3-bromophenyl)-4,6-diphenyl-1,3,5-triazine SMILES: BrC1=CC=CC(=C1)C1=NC(=NC(=N1)C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 58943302 |
|---|---|
| CAS | 864377-31-1 |
| Molecular Weight (g/mol) | 388.27 |
| MDL Number | MFCD22200060 |
| SMILES | BrC1=CC=CC(=C1)C1=NC(=NC(=N1)C1=CC=CC=C1)C1=CC=CC=C1 |
| IUPAC Name | 2-(3-bromophenyl)-4,6-diphenyl-1,3,5-triazine |
| InChI Key | HNZUKQQNZRMNGS-UHFFFAOYSA-N |
| Molecular Formula | C21H14BrN3 |
1-(3-Acetamidophenyl)-5-mercaptotetrazole 98.0+%, TCI America™
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CAS: 14070-48-5 Molecular Formula: C9H9N5OS Molecular Weight (g/mol): 235.27 MDL Number: MFCD00603728 InChI Key: SCWKACOBHZIKDI-UHFFFAOYSA-N PubChem CID: 712430 IUPAC Name: N-[3-(5-sulfanylidene-2,5-dihydro-1H-1,2,3,4-tetrazol-1-yl)phenyl]acetamide SMILES: CC(=O)NC1=CC=CC(=C1)N1NN=NC1=S
| PubChem CID | 712430 |
|---|---|
| CAS | 14070-48-5 |
| Molecular Weight (g/mol) | 235.27 |
| MDL Number | MFCD00603728 |
| SMILES | CC(=O)NC1=CC=CC(=C1)N1NN=NC1=S |
| IUPAC Name | N-[3-(5-sulfanylidene-2,5-dihydro-1H-1,2,3,4-tetrazol-1-yl)phenyl]acetamide |
| InChI Key | SCWKACOBHZIKDI-UHFFFAOYSA-N |
| Molecular Formula | C9H9N5OS |
3-Fluoro-4-hydroxybenzoic Acid Hydrate 98.0+%, TCI America™
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CAS: 350-29-8 Molecular Formula: C7H4FO3 Molecular Weight (g/mol): 155.11 MDL Number: MFCD00143161 InChI Key: IUSDEKNMCOUBEE-UHFFFAOYSA-M Synonym: 4-carboxy-2-fluorophenol,3-fluoro-4-hydroxy benzoic acid,benzoic acid, 3-fluoro-4-hydroxy,3-fluoro-4-hydroxybenzoate,3-fluoro-4-hydroxy-benzoic acid,3pcf,fhb,pubchem2271,acmc-1co6y,ksc222e7d PubChem CID: 160456 IUPAC Name: 3-fluoro-4-hydroxybenzoate SMILES: OC1=CC=C(C=C1F)C([O-])=O
| PubChem CID | 160456 |
|---|---|
| CAS | 350-29-8 |
| Molecular Weight (g/mol) | 155.11 |
| MDL Number | MFCD00143161 |
| SMILES | OC1=CC=C(C=C1F)C([O-])=O |
| Synonym | 4-carboxy-2-fluorophenol,3-fluoro-4-hydroxy benzoic acid,benzoic acid, 3-fluoro-4-hydroxy,3-fluoro-4-hydroxybenzoate,3-fluoro-4-hydroxy-benzoic acid,3pcf,fhb,pubchem2271,acmc-1co6y,ksc222e7d |
| IUPAC Name | 3-fluoro-4-hydroxybenzoate |
| InChI Key | IUSDEKNMCOUBEE-UHFFFAOYSA-M |
| Molecular Formula | C7H4FO3 |
3-Bromophenetole 98.0+%, TCI America™
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CAS: 2655-84-7 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.06 MDL Number: MFCD00274287 InChI Key: LQBMPJSTUHWGDE-UHFFFAOYSA-N Synonym: 3-bromophenetole,benzene, 1-bromo-3-ethoxy,m-bromophenetole,3-bromophenyl ethyl ether,1-bromo-3-ethoxy-benzene,3-bromoethoxybenzene,3-bromphenyl ethyl ether,phenetole, m-bromo,m-bromphenetol,3-ethoxybromobenzene PubChem CID: 75867 IUPAC Name: 1-bromo-3-ethoxybenzene SMILES: CCOC1=CC=CC(Br)=C1
| PubChem CID | 75867 |
|---|---|
| CAS | 2655-84-7 |
| Molecular Weight (g/mol) | 201.06 |
| MDL Number | MFCD00274287 |
| SMILES | CCOC1=CC=CC(Br)=C1 |
| Synonym | 3-bromophenetole,benzene, 1-bromo-3-ethoxy,m-bromophenetole,3-bromophenyl ethyl ether,1-bromo-3-ethoxy-benzene,3-bromoethoxybenzene,3-bromphenyl ethyl ether,phenetole, m-bromo,m-bromphenetol,3-ethoxybromobenzene |
| IUPAC Name | 1-bromo-3-ethoxybenzene |
| InChI Key | LQBMPJSTUHWGDE-UHFFFAOYSA-N |
| Molecular Formula | C8H9BrO |
2-Chloro-4-methoxytoluene 95.0+%, TCI America™
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CAS: 54788-38-4 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.609 MDL Number: MFCD00087376 InChI Key: ZMZVVVASCILFJL-UHFFFAOYSA-N Synonym: 3-chloro-4-methylanisole,2-chloro-4-methoxytoluene,2-chloro-4-methoxy-1-methyl-benzene,benzene, 2-chloro-4-methoxy-1-methyl,pubchem4101,acmc-209xb6,ksc602k7p,benzene,2-chloro-4-methoxy-1-methyl PubChem CID: 6951757 IUPAC Name: 2-chloro-4-methoxy-1-methylbenzene SMILES: CC1=C(C=C(C=C1)OC)Cl
| PubChem CID | 6951757 |
|---|---|
| CAS | 54788-38-4 |
| Molecular Weight (g/mol) | 156.609 |
| MDL Number | MFCD00087376 |
| SMILES | CC1=C(C=C(C=C1)OC)Cl |
| Synonym | 3-chloro-4-methylanisole,2-chloro-4-methoxytoluene,2-chloro-4-methoxy-1-methyl-benzene,benzene, 2-chloro-4-methoxy-1-methyl,pubchem4101,acmc-209xb6,ksc602k7p,benzene,2-chloro-4-methoxy-1-methyl |
| IUPAC Name | 2-chloro-4-methoxy-1-methylbenzene |
| InChI Key | ZMZVVVASCILFJL-UHFFFAOYSA-N |
| Molecular Formula | C8H9ClO |
5-Chloro-2-hydroxy-4-methylbenzophenone 98.0+%, TCI America™
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CAS: 68751-90-6 Molecular Formula: C14H11ClO2 Molecular Weight (g/mol): 246.69 MDL Number: MFCD00002325 InChI Key: IOGQACQRFGDUPT-UHFFFAOYSA-N PubChem CID: 555814 IUPAC Name: 2-benzoyl-4-chloro-5-methylphenol SMILES: CC1=CC(O)=C(C=C1Cl)C(=O)C1=CC=CC=C1
| PubChem CID | 555814 |
|---|---|
| CAS | 68751-90-6 |
| Molecular Weight (g/mol) | 246.69 |
| MDL Number | MFCD00002325 |
| SMILES | CC1=CC(O)=C(C=C1Cl)C(=O)C1=CC=CC=C1 |
| IUPAC Name | 2-benzoyl-4-chloro-5-methylphenol |
| InChI Key | IOGQACQRFGDUPT-UHFFFAOYSA-N |
| Molecular Formula | C14H11ClO2 |
Tris(4-methylphenyl)phosphine Oxide 98.0+%, TCI America™
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CAS: 797-70-6 Molecular Formula: C21H21OP Molecular Weight (g/mol): 320.37 MDL Number: MFCD00059321 InChI Key: SPKBYIYIZQARNX-UHFFFAOYSA-N Synonym: Tri-p-tolylphosphine Oxide PubChem CID: 120383 IUPAC Name: 1-[bis(4-methylphenyl)phosphoroso]-4-methylbenzene SMILES: CC1=CC=C(C=C1)P(=O)(C1=CC=C(C)C=C1)C1=CC=C(C)C=C1
| PubChem CID | 120383 |
|---|---|
| CAS | 797-70-6 |
| Molecular Weight (g/mol) | 320.37 |
| MDL Number | MFCD00059321 |
| SMILES | CC1=CC=C(C=C1)P(=O)(C1=CC=C(C)C=C1)C1=CC=C(C)C=C1 |
| Synonym | Tri-p-tolylphosphine Oxide |
| IUPAC Name | 1-[bis(4-methylphenyl)phosphoroso]-4-methylbenzene |
| InChI Key | SPKBYIYIZQARNX-UHFFFAOYSA-N |
| Molecular Formula | C21H21OP |
Methyl Diphenylacetate 98.0+%, TCI America™
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CAS: 3469-00-9 Molecular Formula: C15H14O2 Molecular Weight (g/mol): 226.28 MDL Number: MFCD00025869 InChI Key: AORIUCNKPVHMTN-UHFFFAOYSA-N Synonym: methyl diphenylacetate,diphenylacetic acid, methyl ester,acetic acid, diphenyl-, methyl ester,benzeneacetic acid, .alpha.-phenyl-, methyl ester,methyldiphenylacetate,cbmicro_020304,acmc-209i9m,c6h5 2chcooch3,diphenylacetic acid methyl ester PubChem CID: 77019 IUPAC Name: methyl 2,2-diphenylacetate SMILES: COC(=O)C(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 77019 |
|---|---|
| CAS | 3469-00-9 |
| Molecular Weight (g/mol) | 226.28 |
| MDL Number | MFCD00025869 |
| SMILES | COC(=O)C(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | methyl diphenylacetate,diphenylacetic acid, methyl ester,acetic acid, diphenyl-, methyl ester,benzeneacetic acid, .alpha.-phenyl-, methyl ester,methyldiphenylacetate,cbmicro_020304,acmc-209i9m,c6h5 2chcooch3,diphenylacetic acid methyl ester |
| IUPAC Name | methyl 2,2-diphenylacetate |
| InChI Key | AORIUCNKPVHMTN-UHFFFAOYSA-N |
| Molecular Formula | C15H14O2 |
2,3,4,6-Tetra-O-benzyl-alpha-D-glucopyranosyl Fluoride 95.0+%, TCI America™
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CAS: 89025-46-7 Molecular Formula: C34H35FO5 Molecular Weight (g/mol): 542.65 MDL Number: MFCD13195515 InChI Key: QNXIKNZDQVSBCO-UHFFFAOYNA-N PubChem CID: 11092783 IUPAC Name: 3,4,5-tris(benzyloxy)-2-[(benzyloxy)methyl]-6-fluorooxane SMILES: FC1OC(COCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C1OCC1=CC=CC=C1
| PubChem CID | 11092783 |
|---|---|
| CAS | 89025-46-7 |
| Molecular Weight (g/mol) | 542.65 |
| MDL Number | MFCD13195515 |
| SMILES | FC1OC(COCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C(OCC2=CC=CC=C2)C1OCC1=CC=CC=C1 |
| IUPAC Name | 3,4,5-tris(benzyloxy)-2-[(benzyloxy)methyl]-6-fluorooxane |
| InChI Key | QNXIKNZDQVSBCO-UHFFFAOYNA-N |
| Molecular Formula | C34H35FO5 |
3'-Hydroxyacetanilide 98.0+%, TCI America™
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CAS: 621-42-1 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00002263 InChI Key: QLNWXBAGRTUKKI-UHFFFAOYSA-N Synonym: 3-acetamidophenol,n-3-hydroxyphenyl acetamide,metacetamol,3'-hydroxyacetanilide,m-acetamidophenol,3-hydroxyacetanilide,n-acetyl-m-aminophenol,m-hydroxyacetanilide,3-acetylamino phenol,metalid PubChem CID: 12124 ChEBI: CHEBI:76987 IUPAC Name: N-(3-hydroxyphenyl)acetamide SMILES: CC(=O)NC1=CC(=CC=C1)O
| PubChem CID | 12124 |
|---|---|
| CAS | 621-42-1 |
| Molecular Weight (g/mol) | 151.165 |
| ChEBI | CHEBI:76987 |
| MDL Number | MFCD00002263 |
| SMILES | CC(=O)NC1=CC(=CC=C1)O |
| Synonym | 3-acetamidophenol,n-3-hydroxyphenyl acetamide,metacetamol,3'-hydroxyacetanilide,m-acetamidophenol,3-hydroxyacetanilide,n-acetyl-m-aminophenol,m-hydroxyacetanilide,3-acetylamino phenol,metalid |
| IUPAC Name | N-(3-hydroxyphenyl)acetamide |
| InChI Key | QLNWXBAGRTUKKI-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO2 |
2,4,5-Trifluoro-1,3-phenylenediamine 98.0+%, TCI America™
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CAS: 321182-37-0 Molecular Formula: C6H5F3N2 Molecular Weight (g/mol): 162.115 MDL Number: MFCD04114298 InChI Key: ONVSXVVJFJJZQX-UHFFFAOYSA-N Synonym: 1,3-Diamino-2,4,5-trifluorobenzene PubChem CID: 15531223 IUPAC Name: 2,4,5-trifluorobenzene-1,3-diamine SMILES: C1=C(C(=C(C(=C1F)F)N)F)N
| PubChem CID | 15531223 |
|---|---|
| CAS | 321182-37-0 |
| Molecular Weight (g/mol) | 162.115 |
| MDL Number | MFCD04114298 |
| SMILES | C1=C(C(=C(C(=C1F)F)N)F)N |
| Synonym | 1,3-Diamino-2,4,5-trifluorobenzene |
| IUPAC Name | 2,4,5-trifluorobenzene-1,3-diamine |
| InChI Key | ONVSXVVJFJJZQX-UHFFFAOYSA-N |
| Molecular Formula | C6H5F3N2 |
2,5-Di-tert-butylhydroquinone 98.0+%, TCI America™
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CAS: 88-58-4 Molecular Formula: C14H22O2 Molecular Weight (g/mol): 222.33 MDL Number: MFCD00008825 InChI Key: JZODKRWQWUWGCD-UHFFFAOYSA-N Synonym: 2,5-di-tert-butylhydroquinone,2,5-di-tert-butylbenzene-1,4-diol,dibug,dtbhq,dybug,santovar o,di-t-butylhydroquinone,2,5-di-tert-butylquinol,nonflex alba,2,5-di-t-butylhydroquinone PubChem CID: 2374 ChEBI: CHEBI:41094 IUPAC Name: 2,5-di-tert-butylbenzene-1,4-diol SMILES: CC(C)(C)C1=CC(O)=C(C=C1O)C(C)(C)C
| PubChem CID | 2374 |
|---|---|
| CAS | 88-58-4 |
| Molecular Weight (g/mol) | 222.33 |
| ChEBI | CHEBI:41094 |
| MDL Number | MFCD00008825 |
| SMILES | CC(C)(C)C1=CC(O)=C(C=C1O)C(C)(C)C |
| Synonym | 2,5-di-tert-butylhydroquinone,2,5-di-tert-butylbenzene-1,4-diol,dibug,dtbhq,dybug,santovar o,di-t-butylhydroquinone,2,5-di-tert-butylquinol,nonflex alba,2,5-di-t-butylhydroquinone |
| IUPAC Name | 2,5-di-tert-butylbenzene-1,4-diol |
| InChI Key | JZODKRWQWUWGCD-UHFFFAOYSA-N |
| Molecular Formula | C14H22O2 |
Etilefrine Hydrochloride 98.0+%, TCI America™
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CAS: 943-17-9 Molecular Formula: C10H16ClNO2 Molecular Weight (g/mol): 217.69 MDL Number: MFCD00060167 InChI Key: KTNROWWHOBZQGK-UHFFFAOYNA-N Synonym: 2-Ethylamino-1-(3-hydroxyphenyl)ethanol Hydrochloride PubChem CID: 164652 IUPAC Name: hydrogen 3-[2-(ethylamino)-1-hydroxyethyl]phenol chloride SMILES: [H+].[Cl-].CCNCC(O)C1=CC=CC(O)=C1
| PubChem CID | 164652 |
|---|---|
| CAS | 943-17-9 |
| Molecular Weight (g/mol) | 217.69 |
| MDL Number | MFCD00060167 |
| SMILES | [H+].[Cl-].CCNCC(O)C1=CC=CC(O)=C1 |
| Synonym | 2-Ethylamino-1-(3-hydroxyphenyl)ethanol Hydrochloride |
| IUPAC Name | hydrogen 3-[2-(ethylamino)-1-hydroxyethyl]phenol chloride |
| InChI Key | KTNROWWHOBZQGK-UHFFFAOYNA-N |
| Molecular Formula | C10H16ClNO2 |