Benzenoids
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N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-L-propargylglycine 98.0+%, TCI America™
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CAS: 198561-07-8 Molecular Formula: C20H17NO4 Molecular Weight (g/mol): 335.359 MDL Number: MFCD01075095 InChI Key: DJGMNCKHNMRKFM-SFHVURJKSA-N Synonym: fmoc-l-propargylglycine,fmoc-pra-oh,fmoc-propargyl-gly-oh,s-2-fmoc-amino-4-pentynoic acid,s-n-fmoc-2-2'-propynyl glycine,2s-2-9h-fluoren-9-ylmethoxycarbonylamino pent-4-ynoic acid,2s-2-9h-fluoren-9-ylmethoxy carbonyl amino pent-4-ynoic acid,s-2-9h-fluoren-9-yl methoxy carbonyl amino pent-4-ynoic acid,4-pentynoic acid, 2-9h-fluoren-9-ylmethoxy carbonyl amino-, 2s,4-pentynoicacid, 2-9h-fluoren-9-ylmethoxy carbonyl amino-, 2s PubChem CID: 2734461 IUPAC Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)pent-4-ynoic acid SMILES: C#CCC(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
| PubChem CID | 2734461 |
|---|---|
| CAS | 198561-07-8 |
| Molecular Weight (g/mol) | 335.359 |
| MDL Number | MFCD01075095 |
| SMILES | C#CCC(C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13 |
| Synonym | fmoc-l-propargylglycine,fmoc-pra-oh,fmoc-propargyl-gly-oh,s-2-fmoc-amino-4-pentynoic acid,s-n-fmoc-2-2'-propynyl glycine,2s-2-9h-fluoren-9-ylmethoxycarbonylamino pent-4-ynoic acid,2s-2-9h-fluoren-9-ylmethoxy carbonyl amino pent-4-ynoic acid,s-2-9h-fluoren-9-yl methoxy carbonyl amino pent-4-ynoic acid,4-pentynoic acid, 2-9h-fluoren-9-ylmethoxy carbonyl amino-, 2s,4-pentynoicacid, 2-9h-fluoren-9-ylmethoxy carbonyl amino-, 2s |
| IUPAC Name | (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)pent-4-ynoic acid |
| InChI Key | DJGMNCKHNMRKFM-SFHVURJKSA-N |
| Molecular Formula | C20H17NO4 |
3,5-Di-tert-butyltoluene 98.0+%, TCI America™
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CAS: 15181-11-0 Molecular Formula: C15H24 Molecular Weight (g/mol): 204.357 MDL Number: MFCD00026300 InChI Key: WIXDSJRJFDWTNY-UHFFFAOYSA-N Synonym: 3,5-di-tert-butyltoluene,1,3-di-tert-butyl-5-methylbenzene,toluene, 3,5-di-tert-butyl,3,5-bis tert-butyl toluene,benzene, 1,3-bis 1,1-dimethylethyl-5-methyl,3,5-di-t-butyltoluene,3,5-bis t-butyl-1-methylbenzene,3,5-di-tert-butyl-1-methylbenzene,1,3-bis tert-butyl-5-methylbenzene PubChem CID: 84819 IUPAC Name: 1,3-ditert-butyl-5-methylbenzene SMILES: CC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C
| PubChem CID | 84819 |
|---|---|
| CAS | 15181-11-0 |
| Molecular Weight (g/mol) | 204.357 |
| MDL Number | MFCD00026300 |
| SMILES | CC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C |
| Synonym | 3,5-di-tert-butyltoluene,1,3-di-tert-butyl-5-methylbenzene,toluene, 3,5-di-tert-butyl,3,5-bis tert-butyl toluene,benzene, 1,3-bis 1,1-dimethylethyl-5-methyl,3,5-di-t-butyltoluene,3,5-bis t-butyl-1-methylbenzene,3,5-di-tert-butyl-1-methylbenzene,1,3-bis tert-butyl-5-methylbenzene |
| IUPAC Name | 1,3-ditert-butyl-5-methylbenzene |
| InChI Key | WIXDSJRJFDWTNY-UHFFFAOYSA-N |
| Molecular Formula | C15H24 |
Tris(4-fluorophenyl)phosphine 98.0+%, TCI America™
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CAS: 18437-78-0 Molecular Formula: C18H12F3P Molecular Weight (g/mol): 316.26 MDL Number: MFCD00013553 InChI Key: GEPJPYNDFSOARB-UHFFFAOYSA-N Synonym: tris 4-fluorophenyl phosphine,phosphine, tris 4-fluorophenyl,tris p-fluorophenyl phosphine,tri 4-fluorophenyl phosphine,tris 4-fluorophenyl phosphane,phosphine, tris p-fluorophenyl,zlchem 700,pubchem6418,acmc-1c3oi PubChem CID: 140387 IUPAC Name: tris(4-fluorophenyl)phosphane SMILES: FC1=CC=C(C=C1)P(C1=CC=C(F)C=C1)C1=CC=C(F)C=C1
| PubChem CID | 140387 |
|---|---|
| CAS | 18437-78-0 |
| Molecular Weight (g/mol) | 316.26 |
| MDL Number | MFCD00013553 |
| SMILES | FC1=CC=C(C=C1)P(C1=CC=C(F)C=C1)C1=CC=C(F)C=C1 |
| Synonym | tris 4-fluorophenyl phosphine,phosphine, tris 4-fluorophenyl,tris p-fluorophenyl phosphine,tri 4-fluorophenyl phosphine,tris 4-fluorophenyl phosphane,phosphine, tris p-fluorophenyl,zlchem 700,pubchem6418,acmc-1c3oi |
| IUPAC Name | tris(4-fluorophenyl)phosphane |
| InChI Key | GEPJPYNDFSOARB-UHFFFAOYSA-N |
| Molecular Formula | C18H12F3P |
1,2-Dibromo-4-fluorobenzene 98.0+%, TCI America™
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CAS: 2369-37-1 Molecular Formula: C6H3Br2F Molecular Weight (g/mol): 253.896 MDL Number: MFCD00070780 InChI Key: RNTGKISRXVFIIP-UHFFFAOYSA-N Synonym: 3,4-dibromofluorobenzene,3,4-dibromo-1-fluorobenzene,pubchem3445,acmc-1ccqu,intermediates-zcf02634,1,2-dibromo-4-fluorobezene,benzene,1,2-dibromo-4-fluoro,1,2-dibromo-4-fluorobenzene,benzene, 1,2-dibromo-4-fluoro PubChem CID: 75402 IUPAC Name: 1,2-dibromo-4-fluorobenzene SMILES: C1=CC(=C(C=C1F)Br)Br
| PubChem CID | 75402 |
|---|---|
| CAS | 2369-37-1 |
| Molecular Weight (g/mol) | 253.896 |
| MDL Number | MFCD00070780 |
| SMILES | C1=CC(=C(C=C1F)Br)Br |
| Synonym | 3,4-dibromofluorobenzene,3,4-dibromo-1-fluorobenzene,pubchem3445,acmc-1ccqu,intermediates-zcf02634,1,2-dibromo-4-fluorobezene,benzene,1,2-dibromo-4-fluoro,1,2-dibromo-4-fluorobenzene,benzene, 1,2-dibromo-4-fluoro |
| IUPAC Name | 1,2-dibromo-4-fluorobenzene |
| InChI Key | RNTGKISRXVFIIP-UHFFFAOYSA-N |
| Molecular Formula | C6H3Br2F |
(-)-Di-p-anisoyl-L-tartaric Acid 97.0+%, TCI America™
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CAS: 50583-51-2 Molecular Formula: C20H18O10 Molecular Weight (g/mol): 418.354 MDL Number: MFCD02682986 InChI Key: KWWCVCFQHGKOMI-HZPDHXFCSA-N Synonym: (-)-Bis(4-methoxybenzoyl)-L-tartaric Acid PubChem CID: 11704418 IUPAC Name: (2R,3R)-2,3-bis[(4-methoxybenzoyl)oxy]butanedioic acid SMILES: COC1=CC=C(C=C1)C(=O)OC(C(C(=O)O)OC(=O)C2=CC=C(C=C2)OC)C(=O)O
| PubChem CID | 11704418 |
|---|---|
| CAS | 50583-51-2 |
| Molecular Weight (g/mol) | 418.354 |
| MDL Number | MFCD02682986 |
| SMILES | COC1=CC=C(C=C1)C(=O)OC(C(C(=O)O)OC(=O)C2=CC=C(C=C2)OC)C(=O)O |
| Synonym | (-)-Bis(4-methoxybenzoyl)-L-tartaric Acid |
| IUPAC Name | (2R,3R)-2,3-bis[(4-methoxybenzoyl)oxy]butanedioic acid |
| InChI Key | KWWCVCFQHGKOMI-HZPDHXFCSA-N |
| Molecular Formula | C20H18O10 |
4-Phenoxyphenol 99.0+%, TCI America™
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CAS: 831-82-3 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00002331 InChI Key: ZSBDGXGICLIJGD-UHFFFAOYSA-N Synonym: p-phenoxyphenol,4-hydroxydiphenyl ether,phenol, 4-phenoxy,p-hydroxydiphenyl ether,phenol, p-phenoxy,hydroquinone monophenyl ether,unii-d83r742gjr,4-phenyloxy phenol,4-phenoxy phenol,4-phenoxy-phenol PubChem CID: 13254 ChEBI: CHEBI:39264 IUPAC Name: 4-phenoxyphenol SMILES: C1=CC=C(C=C1)OC2=CC=C(C=C2)O
| PubChem CID | 13254 |
|---|---|
| CAS | 831-82-3 |
| Molecular Weight (g/mol) | 186.21 |
| ChEBI | CHEBI:39264 |
| MDL Number | MFCD00002331 |
| SMILES | C1=CC=C(C=C1)OC2=CC=C(C=C2)O |
| Synonym | p-phenoxyphenol,4-hydroxydiphenyl ether,phenol, 4-phenoxy,p-hydroxydiphenyl ether,phenol, p-phenoxy,hydroquinone monophenyl ether,unii-d83r742gjr,4-phenyloxy phenol,4-phenoxy phenol,4-phenoxy-phenol |
| IUPAC Name | 4-phenoxyphenol |
| InChI Key | ZSBDGXGICLIJGD-UHFFFAOYSA-N |
| Molecular Formula | C12H10O2 |
N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-4-aminobutyric Acid 98.0+%, TCI America™
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CAS: 116821-47-7 Molecular Formula: C19H19NO4 Molecular Weight (g/mol): 325.364 MDL Number: MFCD00144889 InChI Key: ACUIFAAXWDLLTR-UHFFFAOYSA-N Synonym: fmoc-gaba-oh,fmoc-gamma-abu-oh,fmoc-gaba,n-fmoc-dl-4-amino-butyric acid,4-9h-fluoren-9-ylmethoxycarbonylamino butanoic acid,4-9h-fluoren-9-yl methoxy carbonyl amino butanoic acid,n-fmoc-4-aminobutyric acid,4-9h-fluoren-9-ylmethoxy carbonyl amino butanoic acid,n-gamma-fmoc-gamma-aminobutyric acid,4-9h-fluoren-9-yl methoxy carbonylamino butanoic acid PubChem CID: 2756086 IUPAC Name: 4-(9H-fluoren-9-ylmethoxycarbonylamino)butanoic acid SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCCC(=O)O
| PubChem CID | 2756086 |
|---|---|
| CAS | 116821-47-7 |
| Molecular Weight (g/mol) | 325.364 |
| MDL Number | MFCD00144889 |
| SMILES | C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCCC(=O)O |
| Synonym | fmoc-gaba-oh,fmoc-gamma-abu-oh,fmoc-gaba,n-fmoc-dl-4-amino-butyric acid,4-9h-fluoren-9-ylmethoxycarbonylamino butanoic acid,4-9h-fluoren-9-yl methoxy carbonyl amino butanoic acid,n-fmoc-4-aminobutyric acid,4-9h-fluoren-9-ylmethoxy carbonyl amino butanoic acid,n-gamma-fmoc-gamma-aminobutyric acid,4-9h-fluoren-9-yl methoxy carbonylamino butanoic acid |
| IUPAC Name | 4-(9H-fluoren-9-ylmethoxycarbonylamino)butanoic acid |
| InChI Key | ACUIFAAXWDLLTR-UHFFFAOYSA-N |
| Molecular Formula | C19H19NO4 |
Methyl Acetylsalicylate 98.0+%, TCI America™
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CAS: 580-02-9 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.186 MDL Number: MFCD00014978 InChI Key: ONWPLBKWMAUFGZ-UHFFFAOYSA-N Synonym: 2-Acetoxybenzoic Acid Methyl Ester, Methyl 2-Acetoxybenzoate, Acetylsalicylic Acid Methyl Ester PubChem CID: 68484 IUPAC Name: methyl 2-acetyloxybenzoate SMILES: CC(=O)OC1=CC=CC=C1C(=O)OC
| PubChem CID | 68484 |
|---|---|
| CAS | 580-02-9 |
| Molecular Weight (g/mol) | 194.186 |
| MDL Number | MFCD00014978 |
| SMILES | CC(=O)OC1=CC=CC=C1C(=O)OC |
| Synonym | 2-Acetoxybenzoic Acid Methyl Ester, Methyl 2-Acetoxybenzoate, Acetylsalicylic Acid Methyl Ester |
| IUPAC Name | methyl 2-acetyloxybenzoate |
| InChI Key | ONWPLBKWMAUFGZ-UHFFFAOYSA-N |
| Molecular Formula | C10H10O4 |
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 |
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 |
N,N-Diethyl-p-toluenesulfonamide 98.0+%, TCI America™
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CAS: 649-15-0 Molecular Formula: C11H17NO2S Molecular Weight (g/mol): 227.322 MDL Number: MFCD00059369 InChI Key: AOJBACHWNDMRQP-UHFFFAOYSA-N Synonym: n,n-diethyl-p-toluenesulfonamide,p-toluenesulfonamide, n,n-diethyl,p-toluenesulfonyl-n,n-diethylamide,benzenesulfonamide, n,n-diethyl-4-methyl,p-toluenesulfonyl-n-diethylamide,n,n-diethyl-4-methylbenzolsulfonamid,acmc-209nol,maybridge1_002134,cambridge id 5116375,p-toluenesulfonamide,n-diethyl PubChem CID: 69539 IUPAC Name: N,N-diethyl-4-methylbenzenesulfonamide SMILES: CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C
| PubChem CID | 69539 |
|---|---|
| CAS | 649-15-0 |
| Molecular Weight (g/mol) | 227.322 |
| MDL Number | MFCD00059369 |
| SMILES | CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C |
| Synonym | n,n-diethyl-p-toluenesulfonamide,p-toluenesulfonamide, n,n-diethyl,p-toluenesulfonyl-n,n-diethylamide,benzenesulfonamide, n,n-diethyl-4-methyl,p-toluenesulfonyl-n-diethylamide,n,n-diethyl-4-methylbenzolsulfonamid,acmc-209nol,maybridge1_002134,cambridge id 5116375,p-toluenesulfonamide,n-diethyl |
| IUPAC Name | N,N-diethyl-4-methylbenzenesulfonamide |
| InChI Key | AOJBACHWNDMRQP-UHFFFAOYSA-N |
| Molecular Formula | C11H17NO2S |
Methyl 3-Bromo-2-methylbenzoate 98.0+%, TCI America™
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CAS: 99548-54-6 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD09031772 InChI Key: MKQQTCSBXHAYQL-UHFFFAOYSA-N Synonym: 3-Bromo-2-methylbenzoic Acid Methyl Ester, Methyl 3-Bromo-o-toluate, 3-Bromo-o-toluic Acid Methyl Ester PubChem CID: 12929135 IUPAC Name: methyl 3-bromo-2-methylbenzoate SMILES: CC1=C(C=CC=C1Br)C(=O)OC
| PubChem CID | 12929135 |
|---|---|
| CAS | 99548-54-6 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD09031772 |
| SMILES | CC1=C(C=CC=C1Br)C(=O)OC |
| Synonym | 3-Bromo-2-methylbenzoic Acid Methyl Ester, Methyl 3-Bromo-o-toluate, 3-Bromo-o-toluic Acid Methyl Ester |
| IUPAC Name | methyl 3-bromo-2-methylbenzoate |
| InChI Key | MKQQTCSBXHAYQL-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
4-Bromo-2-chlorophenol 97.0+%, TCI America™
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CAS: 3964-56-5 Molecular Formula: C6H4BrClO Molecular Weight (g/mol): 207.45 MDL Number: MFCD00002166 InChI Key: VIBJPUXLAKVICD-UHFFFAOYSA-N Synonym: 2-chloro-4-bromophenol,phenol, 4-bromo-2-chloro,phenol, 4-bromochloro,unii-994sj34d8p,4-bromo-2-chloro-phenol,attercop-chm at106179,4-bromo-2-chlorophenol 25gr,4-bromo-chlorophenol,pubchem3596,acmc-209j6p PubChem CID: 19859 ChEBI: CHEBI:38852 IUPAC Name: 4-bromo-2-chlorophenol SMILES: OC1=CC=C(Br)C=C1Cl
| PubChem CID | 19859 |
|---|---|
| CAS | 3964-56-5 |
| Molecular Weight (g/mol) | 207.45 |
| ChEBI | CHEBI:38852 |
| MDL Number | MFCD00002166 |
| SMILES | OC1=CC=C(Br)C=C1Cl |
| Synonym | 2-chloro-4-bromophenol,phenol, 4-bromo-2-chloro,phenol, 4-bromochloro,unii-994sj34d8p,4-bromo-2-chloro-phenol,attercop-chm at106179,4-bromo-2-chlorophenol 25gr,4-bromo-chlorophenol,pubchem3596,acmc-209j6p |
| IUPAC Name | 4-bromo-2-chlorophenol |
| InChI Key | VIBJPUXLAKVICD-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrClO |
1,2,3,4,5,6,7,8-Octahydrophenanthrene 98.0+%, TCI America™
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CAS: 5325-97-3 Molecular Formula: C14H18 Molecular Weight (g/mol): 186.30 MDL Number: MFCD00058943 InChI Key: YSZLFGZFQTTZIQ-UHFFFAOYSA-N PubChem CID: 79221 IUPAC Name: 1,2,3,4,5,6,7,8-octahydrophenanthrene SMILES: C1CCC2=C(C1)C=CC1=C2CCCC1
| PubChem CID | 79221 |
|---|---|
| CAS | 5325-97-3 |
| Molecular Weight (g/mol) | 186.30 |
| MDL Number | MFCD00058943 |
| SMILES | C1CCC2=C(C1)C=CC1=C2CCCC1 |
| IUPAC Name | 1,2,3,4,5,6,7,8-octahydrophenanthrene |
| InChI Key | YSZLFGZFQTTZIQ-UHFFFAOYSA-N |
| Molecular Formula | C14H18 |
4-Methoxy-3-(trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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CAS: 149507-36-8 Molecular Formula: C8H8BF3O3 Molecular Weight (g/mol): 219.954 MDL Number: MFCD07363790 InChI Key: BUSMBMGODABSIN-UHFFFAOYSA-N Synonym: 4-methoxy-3-trifluoromethyl phenyl boronic acid,4-methoxy-3-trifluoromethylphenylboronic acid,3-trifluoromethyl-4-methoxy-phenylboronic acid,4-methoxy-3-trifluoromethylphenyl boronic acid,4-methoxy-3-trifluoromethyl benzeneboronic acid,4-methoxy-3-trifluoromethyl phenylboronic acid,boronic acid, 4-methoxy-3-trifluoromethyl phenyl,acmc-1c5ik PubChem CID: 17750052 IUPAC Name: [4-methoxy-3-(trifluoromethyl)phenyl]boronic acid SMILES: B(C1=CC(=C(C=C1)OC)C(F)(F)F)(O)O
| PubChem CID | 17750052 |
|---|---|
| CAS | 149507-36-8 |
| Molecular Weight (g/mol) | 219.954 |
| MDL Number | MFCD07363790 |
| SMILES | B(C1=CC(=C(C=C1)OC)C(F)(F)F)(O)O |
| Synonym | 4-methoxy-3-trifluoromethyl phenyl boronic acid,4-methoxy-3-trifluoromethylphenylboronic acid,3-trifluoromethyl-4-methoxy-phenylboronic acid,4-methoxy-3-trifluoromethylphenyl boronic acid,4-methoxy-3-trifluoromethyl benzeneboronic acid,4-methoxy-3-trifluoromethyl phenylboronic acid,boronic acid, 4-methoxy-3-trifluoromethyl phenyl,acmc-1c5ik |
| IUPAC Name | [4-methoxy-3-(trifluoromethyl)phenyl]boronic acid |
| InChI Key | BUSMBMGODABSIN-UHFFFAOYSA-N |
| Molecular Formula | C8H8BF3O3 |