Benzenoids
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3-Amino-4-fluorobenzotrifluoride 98.0+%, TCI America™
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CAS: 535-52-4 Molecular Formula: C7H5F4N Molecular Weight (g/mol): 179.118 MDL Number: MFCD00007653 InChI Key: DRKWGMXFFCPZLW-UHFFFAOYSA-N Synonym: 2-fluoro-5-trifluoromethyl aniline,3-amino-4-fluorobenzotrifluoride,alpha,alpha,alpha,6-tetrafluoro-m-toluidine,4-fluoro-3-aminobenzotrifluoride,2-fluoro-5-trifluoromethyl benzenamine,2-fluoro-5-trifluoromethyl phenylamine,benzenamine, 2-fluoro-5-trifluoromethyl,.alpha.,.alpha.,.alpha.,6-tetrafluoro-m-toluidine,pubchem1538,ksc494s7l PubChem CID: 136349 IUPAC Name: 2-fluoro-5-(trifluoromethyl)aniline SMILES: C1=CC(=C(C=C1C(F)(F)F)N)F
| PubChem CID | 136349 |
|---|---|
| CAS | 535-52-4 |
| Molecular Weight (g/mol) | 179.118 |
| MDL Number | MFCD00007653 |
| SMILES | C1=CC(=C(C=C1C(F)(F)F)N)F |
| Synonym | 2-fluoro-5-trifluoromethyl aniline,3-amino-4-fluorobenzotrifluoride,alpha,alpha,alpha,6-tetrafluoro-m-toluidine,4-fluoro-3-aminobenzotrifluoride,2-fluoro-5-trifluoromethyl benzenamine,2-fluoro-5-trifluoromethyl phenylamine,benzenamine, 2-fluoro-5-trifluoromethyl,.alpha.,.alpha.,.alpha.,6-tetrafluoro-m-toluidine,pubchem1538,ksc494s7l |
| IUPAC Name | 2-fluoro-5-(trifluoromethyl)aniline |
| InChI Key | DRKWGMXFFCPZLW-UHFFFAOYSA-N |
| Molecular Formula | C7H5F4N |
4-(2-Methoxyethyl)phenol 98.0+%, TCI America™
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CAS: 56718-71-9 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00017537 InChI Key: FAYGEALAEQKPDI-UHFFFAOYSA-N Synonym: 4-2-methoxyethyl phenol,p-2-methoxyethyl phenol,phenol, 4-2-methoxyethyl,4-methoxyethylphenol,unii-py1w0akw8i,metoprolol impurity b,metoprolol impurity i,py1w0akw8i,4-hydroxyphenylethyl methyl ether PubChem CID: 92516 IUPAC Name: 4-(2-methoxyethyl)phenol SMILES: COCCC1=CC=C(C=C1)O
| PubChem CID | 92516 |
|---|---|
| CAS | 56718-71-9 |
| Molecular Weight (g/mol) | 152.193 |
| MDL Number | MFCD00017537 |
| SMILES | COCCC1=CC=C(C=C1)O |
| Synonym | 4-2-methoxyethyl phenol,p-2-methoxyethyl phenol,phenol, 4-2-methoxyethyl,4-methoxyethylphenol,unii-py1w0akw8i,metoprolol impurity b,metoprolol impurity i,py1w0akw8i,4-hydroxyphenylethyl methyl ether |
| IUPAC Name | 4-(2-methoxyethyl)phenol |
| InChI Key | FAYGEALAEQKPDI-UHFFFAOYSA-N |
| Molecular Formula | C9H12O2 |
Ethyl Vanillate 98.0+%, TCI America™
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CAS: 617-05-0 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.20 MDL Number: MFCD00017269 InChI Key: MWAYRGBWOVHDDZ-UHFFFAOYSA-N Synonym: ethyl vanillate,vanillic acid, ethyl ester,4-hydroxy-3-methoxybenzoic acid ethyl ester,benzoic acid, 4-hydroxy-3-methoxy-, ethyl ester,unii-v38jk4z93o,3-methoxy-4-hydroxybenzoic acid, ethyl ester,m-anisic acid, 4-hydroxy-, ethyl ester,vanilicacidethylester,ethyl 4-hydroxy-3-methoxy-benzoate,ethylvanillate PubChem CID: 12038 IUPAC Name: ethyl 4-hydroxy-3-methoxybenzoate SMILES: CCOC(=O)C1=CC=C(O)C(OC)=C1
| PubChem CID | 12038 |
|---|---|
| CAS | 617-05-0 |
| Molecular Weight (g/mol) | 196.20 |
| MDL Number | MFCD00017269 |
| SMILES | CCOC(=O)C1=CC=C(O)C(OC)=C1 |
| Synonym | ethyl vanillate,vanillic acid, ethyl ester,4-hydroxy-3-methoxybenzoic acid ethyl ester,benzoic acid, 4-hydroxy-3-methoxy-, ethyl ester,unii-v38jk4z93o,3-methoxy-4-hydroxybenzoic acid, ethyl ester,m-anisic acid, 4-hydroxy-, ethyl ester,vanilicacidethylester,ethyl 4-hydroxy-3-methoxy-benzoate,ethylvanillate |
| IUPAC Name | ethyl 4-hydroxy-3-methoxybenzoate |
| InChI Key | MWAYRGBWOVHDDZ-UHFFFAOYSA-N |
| Molecular Formula | C10H12O4 |
Fmoc-D-Arg(Pbf)-OH 98.0+%, TCI America™
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CAS: 187618-60-6 Molecular Formula: C34H40N4O7S Molecular Weight (g/mol): 648.78 MDL Number: MFCD00237010 InChI Key: HNICLNKVURBTKV-UHFFFAOYNA-N Synonym: fmoc-d-arg pbf-oh,r-2-9h-fluoren-9-yl methoxy carbonyl amino-5-3-2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-yl sulfonyl guanidino pentanoic acid,2r-2-9h-fluoren-9-yl methoxy carbonyl amino-5-n'-2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl sulfonyl carbamimidamido pentanoic acid,2r-2-9h-fluoren-9-ylmethoxy carbonyl amino-5-n'-2,2,4,6,7-pentamethyl-3h-1-benzofuran-5-ylsulfonyl carbamimidamido pentanoic acid,ambotzfaa1305,fmoc-darg pbf-oh,pubchem12397,na-fmoc-n?-pbf-d-arginine,fmoc-n-guanidino-pbf-d-arginine,nalpha-fmoc-nomega-pbf-d-arginine PubChem CID: 46737258 IUPAC Name: 5-{[amino(2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-sulfonamido)methylidene]amino}-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)pentanoic acid SMILES: CC1=C2CC(C)(C)OC2=C(C)C(C)=C1S(=O)(=O)NC(N)=NCCCC(NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C(O)=O
| PubChem CID | 46737258 |
|---|---|
| CAS | 187618-60-6 |
| Molecular Weight (g/mol) | 648.78 |
| MDL Number | MFCD00237010 |
| SMILES | CC1=C2CC(C)(C)OC2=C(C)C(C)=C1S(=O)(=O)NC(N)=NCCCC(NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C(O)=O |
| Synonym | fmoc-d-arg pbf-oh,r-2-9h-fluoren-9-yl methoxy carbonyl amino-5-3-2,2,4,6,7-pentamethyl-2,3-dihydrobenzofuran-5-yl sulfonyl guanidino pentanoic acid,2r-2-9h-fluoren-9-yl methoxy carbonyl amino-5-n'-2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-yl sulfonyl carbamimidamido pentanoic acid,2r-2-9h-fluoren-9-ylmethoxy carbonyl amino-5-n'-2,2,4,6,7-pentamethyl-3h-1-benzofuran-5-ylsulfonyl carbamimidamido pentanoic acid,ambotzfaa1305,fmoc-darg pbf-oh,pubchem12397,na-fmoc-n?-pbf-d-arginine,fmoc-n-guanidino-pbf-d-arginine,nalpha-fmoc-nomega-pbf-d-arginine |
| IUPAC Name | 5-{[amino(2,2,4,6,7-pentamethyl-2,3-dihydro-1-benzofuran-5-sulfonamido)methylidene]amino}-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)pentanoic acid |
| InChI Key | HNICLNKVURBTKV-UHFFFAOYNA-N |
| Molecular Formula | C34H40N4O7S |
Triphenyl Phosphite 97.0+%, TCI America™
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1,1'-Thiobis(2-naphthol) 98.0+%, TCI America™
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CAS: 17096-15-0 Molecular Formula: C20H14O2S Molecular Weight (g/mol): 318.39 MDL Number: MFCD00046469 InChI Key: HGYMQZVPTMKXGI-UHFFFAOYSA-N Synonym: Bis(2-hydroxy-1-naphthyl) Sulfide, 1,1′C-Thiodi(2-naphthol) PubChem CID: 86951 IUPAC Name: 1-(2-hydroxynaphthalen-1-yl)sulfanylnaphthalen-2-ol SMILES: C1=CC=C2C(=C1)C=CC(=C2SC3=C(C=CC4=CC=CC=C43)O)O
| PubChem CID | 86951 |
|---|---|
| CAS | 17096-15-0 |
| Molecular Weight (g/mol) | 318.39 |
| MDL Number | MFCD00046469 |
| SMILES | C1=CC=C2C(=C1)C=CC(=C2SC3=C(C=CC4=CC=CC=C43)O)O |
| Synonym | Bis(2-hydroxy-1-naphthyl) Sulfide, 1,1′C-Thiodi(2-naphthol) |
| IUPAC Name | 1-(2-hydroxynaphthalen-1-yl)sulfanylnaphthalen-2-ol |
| InChI Key | HGYMQZVPTMKXGI-UHFFFAOYSA-N |
| Molecular Formula | C20H14O2S |
1,2,3,4-Tetrahydronaphthalene 98.0+%, TCI America™
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CAS: 119-64-2 Molecular Formula: C10H12 Molecular Weight (g/mol): 132.21 MDL Number: MFCD00001733 InChI Key: CXWXQJXEFPUFDZ-UHFFFAOYSA-N Synonym: tetralin,benzocyclohexane,tetrahydronaphthalene,bacticin,tetraline,tetranap,naphthalene, 1,2,3,4-tetrahydro,tetralina,naphthalene 1,2,3,4-tetrahydride,tetralene PubChem CID: 8404 ChEBI: CHEBI:35008 IUPAC Name: 1,2,3,4-tetrahydronaphthalene SMILES: C1CCC2=CC=CC=C2C1
| PubChem CID | 8404 |
|---|---|
| CAS | 119-64-2 |
| Molecular Weight (g/mol) | 132.21 |
| ChEBI | CHEBI:35008 |
| MDL Number | MFCD00001733 |
| SMILES | C1CCC2=CC=CC=C2C1 |
| Synonym | tetralin,benzocyclohexane,tetrahydronaphthalene,bacticin,tetraline,tetranap,naphthalene, 1,2,3,4-tetrahydro,tetralina,naphthalene 1,2,3,4-tetrahydride,tetralene |
| IUPAC Name | 1,2,3,4-tetrahydronaphthalene |
| InChI Key | CXWXQJXEFPUFDZ-UHFFFAOYSA-N |
| Molecular Formula | C10H12 |
1,3-Diphenyl-2-thiourea 98.0+%, TCI America™
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CAS: 102-08-9 Molecular Formula: C13H12N2S Molecular Weight (g/mol): 228.31 MDL Number: MFCD00004921 InChI Key: FCSHMCFRCYZTRQ-UHFFFAOYSA-N Synonym: thiocarbanilide,diphenylthiourea,1,3-diphenyl-2-thiourea,n,n'-diphenylthiourea,sulfocarbanilide,sym-diphenylthiourea,thiourea, n,n'-diphenyl,stabilisator c,rhenocure ca,vulkacit ca PubChem CID: 700999 IUPAC Name: 1,3-diphenylthiourea SMILES: S=C(NC1=CC=CC=C1)NC1=CC=CC=C1
| PubChem CID | 700999 |
|---|---|
| CAS | 102-08-9 |
| Molecular Weight (g/mol) | 228.31 |
| MDL Number | MFCD00004921 |
| SMILES | S=C(NC1=CC=CC=C1)NC1=CC=CC=C1 |
| Synonym | thiocarbanilide,diphenylthiourea,1,3-diphenyl-2-thiourea,n,n'-diphenylthiourea,sulfocarbanilide,sym-diphenylthiourea,thiourea, n,n'-diphenyl,stabilisator c,rhenocure ca,vulkacit ca |
| IUPAC Name | 1,3-diphenylthiourea |
| InChI Key | FCSHMCFRCYZTRQ-UHFFFAOYSA-N |
| Molecular Formula | C13H12N2S |
3,5-Di-tert-butylbenzoic Acid 98.0+%, TCI America™
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CAS: 16225-26-6 Molecular Formula: C15H22O2 Molecular Weight (g/mol): 234.339 MDL Number: MFCD00082727 InChI Key: NCTSLPBQVXUAHR-UHFFFAOYSA-N Synonym: 3,5-di-tert-butylbenzoic acid,3,5-di-t-butylbenzoic acid,3,5-ditertbutylbenzoic acid,3,5-di-tert-butylbenzoicacid,3,5-bis tert-butyl benzoic acid,benzoic acid, 3,5-bis 1,1-dimethylethyl,pubchem4953,acmc-209do2,3,5-di-tertbutylbenzoic acid,ksc494i2n PubChem CID: 85339 IUPAC Name: 3,5-ditert-butylbenzoic acid SMILES: CC(C)(C)C1=CC(=CC(=C1)C(=O)O)C(C)(C)C
| PubChem CID | 85339 |
|---|---|
| CAS | 16225-26-6 |
| Molecular Weight (g/mol) | 234.339 |
| MDL Number | MFCD00082727 |
| SMILES | CC(C)(C)C1=CC(=CC(=C1)C(=O)O)C(C)(C)C |
| Synonym | 3,5-di-tert-butylbenzoic acid,3,5-di-t-butylbenzoic acid,3,5-ditertbutylbenzoic acid,3,5-di-tert-butylbenzoicacid,3,5-bis tert-butyl benzoic acid,benzoic acid, 3,5-bis 1,1-dimethylethyl,pubchem4953,acmc-209do2,3,5-di-tertbutylbenzoic acid,ksc494i2n |
| IUPAC Name | 3,5-ditert-butylbenzoic acid |
| InChI Key | NCTSLPBQVXUAHR-UHFFFAOYSA-N |
| Molecular Formula | C15H22O2 |
3-Iodo-p-toluic Acid 98.0+%, TCI America™
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CAS: 82998-57-0 Molecular Formula: C8H7IO2 Molecular Weight (g/mol): 262.046 MDL Number: MFCD00010392 InChI Key: LDDHMKANNXWUAK-UHFFFAOYSA-N Synonym: 3-iodo-4-methyl-benzoic acid,benzoic acid, 3-iodo-4-methyl,zlchem 953,3-iodo-p-toluicacid,pubchem3947,4-carboxy-2-iodotoluene,akos bbb/227,ksc449e9t,3-iodo-4-methyl benzoic acid,paragos 440021 PubChem CID: 621640 IUPAC Name: 3-iodo-4-methylbenzoic acid SMILES: CC1=C(C=C(C=C1)C(=O)O)I
| PubChem CID | 621640 |
|---|---|
| CAS | 82998-57-0 |
| Molecular Weight (g/mol) | 262.046 |
| MDL Number | MFCD00010392 |
| SMILES | CC1=C(C=C(C=C1)C(=O)O)I |
| Synonym | 3-iodo-4-methyl-benzoic acid,benzoic acid, 3-iodo-4-methyl,zlchem 953,3-iodo-p-toluicacid,pubchem3947,4-carboxy-2-iodotoluene,akos bbb/227,ksc449e9t,3-iodo-4-methyl benzoic acid,paragos 440021 |
| IUPAC Name | 3-iodo-4-methylbenzoic acid |
| InChI Key | LDDHMKANNXWUAK-UHFFFAOYSA-N |
| Molecular Formula | C8H7IO2 |
N-[(Trimethylsilyl)methyl]benzylamine 96.0+%, TCI America™
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CAS: 53215-95-5 Molecular Formula: C11H19NSi Molecular Weight (g/mol): 193.37 MDL Number: MFCD00012192 InChI Key: WECLUYCAWLJMKM-UHFFFAOYSA-N Synonym: n-trimethylsilylmethyl benzylamine,n-trimethylsilyl methyl benzylamine,benzyl trimethylsilyl methyl amine,n-benzyl-1-trimethylsilyl methylamine,1-phenyl-n-trimethylsilylmethyl methanamine,benzyl trimethylsilylmethyl amine,n-benzyl-1-trimethylsilyl methanamine,benzenemethanamine, n-trimethylsilyl methyl,n-benzylaminomethyltrimethylsilane,n-benzyl-n-trimethylsilyl methyl amine PubChem CID: 353458 IUPAC Name: benzyl[(trimethylsilyl)methyl]amine SMILES: C[Si](C)(C)CNCC1=CC=CC=C1
| PubChem CID | 353458 |
|---|---|
| CAS | 53215-95-5 |
| Molecular Weight (g/mol) | 193.37 |
| MDL Number | MFCD00012192 |
| SMILES | C[Si](C)(C)CNCC1=CC=CC=C1 |
| Synonym | n-trimethylsilylmethyl benzylamine,n-trimethylsilyl methyl benzylamine,benzyl trimethylsilyl methyl amine,n-benzyl-1-trimethylsilyl methylamine,1-phenyl-n-trimethylsilylmethyl methanamine,benzyl trimethylsilylmethyl amine,n-benzyl-1-trimethylsilyl methanamine,benzenemethanamine, n-trimethylsilyl methyl,n-benzylaminomethyltrimethylsilane,n-benzyl-n-trimethylsilyl methyl amine |
| IUPAC Name | benzyl[(trimethylsilyl)methyl]amine |
| InChI Key | WECLUYCAWLJMKM-UHFFFAOYSA-N |
| Molecular Formula | C11H19NSi |
2,3,4,6-Tetra-O-benzyl-beta-D-glucopyranosyl Fluoride 96.0+%, TCI America™
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CAS: 78153-79-4 Molecular Formula: C34H35FO5 Molecular Weight (g/mol): 542.65 MDL Number: MFCD01862264 InChI Key: QNXIKNZDQVSBCO-UHFFFAOYNA-N PubChem CID: 10886059 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 | 10886059 |
|---|---|
| CAS | 78153-79-4 |
| Molecular Weight (g/mol) | 542.65 |
| MDL Number | MFCD01862264 |
| 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-Fluoro-p-anisaldehyde 98.0+%, TCI America™
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CAS: 351-54-2 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 InChI Key: SOQCZBSZZLWDGU-UHFFFAOYSA-N Synonym: 3-fluoro-p-anisaldehyde,3-fluoro-4-methoxy-benzaldehyde,3-fluoro-4-anisaldehyde,benzaldehyde, 3-fluoro-4-methoxy,3-fluoro-4-methoxy benzaldehyde,3-fluoroanisaldehyde,3-fluoro-anisaldehyde,pubchem1448,acmc-209idn,2-fluoro-4-formylanisole PubChem CID: 67696 IUPAC Name: 3-fluoro-4-methoxybenzaldehyde SMILES: COC1=C(C=C(C=C1)C=O)F
| PubChem CID | 67696 |
|---|---|
| CAS | 351-54-2 |
| Molecular Weight (g/mol) | 154.14 |
| SMILES | COC1=C(C=C(C=C1)C=O)F |
| Synonym | 3-fluoro-p-anisaldehyde,3-fluoro-4-methoxy-benzaldehyde,3-fluoro-4-anisaldehyde,benzaldehyde, 3-fluoro-4-methoxy,3-fluoro-4-methoxy benzaldehyde,3-fluoroanisaldehyde,3-fluoro-anisaldehyde,pubchem1448,acmc-209idn,2-fluoro-4-formylanisole |
| IUPAC Name | 3-fluoro-4-methoxybenzaldehyde |
| InChI Key | SOQCZBSZZLWDGU-UHFFFAOYSA-N |
| Molecular Formula | C8H7FO2 |
4-Bromobenzotrifluoride 98.0+%, TCI America™
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CAS: 402-43-7 Molecular Formula: C7H4BrF3 Molecular Weight (g/mol): 225.008 MDL Number: MFCD00000398 InChI Key: XLQSXGGDTHANLN-UHFFFAOYSA-N Synonym: 4-bromobenzotrifluoride,1-bromo-4-trifluoromethyl benzene,benzene, 1-bromo-4-trifluoromethyl,p-bromobenzotrifluoride,4-bromotrifluorotoluene,4-bromo-alpha,alpha,alpha-trifluorotoluene,p-bromotrifluoromethylbenzene,4-trifluoromethyl bromobenzene,4-bromo-a,a,a-trifluorotoluene,4-trifluoromethylbromobenzene PubChem CID: 67872 IUPAC Name: 1-bromo-4-(trifluoromethyl)benzene SMILES: C1=CC(=CC=C1C(F)(F)F)Br
| PubChem CID | 67872 |
|---|---|
| CAS | 402-43-7 |
| Molecular Weight (g/mol) | 225.008 |
| MDL Number | MFCD00000398 |
| SMILES | C1=CC(=CC=C1C(F)(F)F)Br |
| Synonym | 4-bromobenzotrifluoride,1-bromo-4-trifluoromethyl benzene,benzene, 1-bromo-4-trifluoromethyl,p-bromobenzotrifluoride,4-bromotrifluorotoluene,4-bromo-alpha,alpha,alpha-trifluorotoluene,p-bromotrifluoromethylbenzene,4-trifluoromethyl bromobenzene,4-bromo-a,a,a-trifluorotoluene,4-trifluoromethylbromobenzene |
| IUPAC Name | 1-bromo-4-(trifluoromethyl)benzene |
| InChI Key | XLQSXGGDTHANLN-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrF3 |
2-Methyl-2-phenoxypropionic Acid 98.0+%, TCI America™
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CAS: 943-45-3 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00129939 InChI Key: ILPUOPPYSQEBNJ-UHFFFAOYSA-N Synonym: 2-Phenoxyisobutyric Acid PubChem CID: 70343 IUPAC Name: 2-methyl-2-phenoxypropanoic acid SMILES: CC(C)(C(=O)O)OC1=CC=CC=C1
| PubChem CID | 70343 |
|---|---|
| CAS | 943-45-3 |
| Molecular Weight (g/mol) | 180.203 |
| MDL Number | MFCD00129939 |
| SMILES | CC(C)(C(=O)O)OC1=CC=CC=C1 |
| Synonym | 2-Phenoxyisobutyric Acid |
| IUPAC Name | 2-methyl-2-phenoxypropanoic acid |
| InChI Key | ILPUOPPYSQEBNJ-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |