Benzenoids
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4-(4-Fluorophenoxy)benzaldehyde 98.0+%, TCI America™
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CAS: 137736-06-2 Molecular Formula: C13H9FO2 Molecular Weight (g/mol): 216.21 MDL Number: MFCD01631896 InChI Key: YUPBWHURNLRZQL-UHFFFAOYSA-N Synonym: 4-4-fluorophenoxy benzaldehyde,4-4'-fluorophenoxy benzaldehyde,4-4-fluoro-phenoxy-benzaldehyde,benzaldehyde, 4-4-fluorophenoxy,pubchem23015,acmc-209ceq,yupbwhurnlrzql-uhfffaoysa,4-4-fluorophenoxyl benzaldehyde,4-fluoro-4'-formyldiphenyl ether PubChem CID: 3856802 IUPAC Name: 4-(4-fluorophenoxy)benzaldehyde SMILES: FC1=CC=C(OC2=CC=C(C=O)C=C2)C=C1
| PubChem CID | 3856802 |
|---|---|
| CAS | 137736-06-2 |
| Molecular Weight (g/mol) | 216.21 |
| MDL Number | MFCD01631896 |
| SMILES | FC1=CC=C(OC2=CC=C(C=O)C=C2)C=C1 |
| Synonym | 4-4-fluorophenoxy benzaldehyde,4-4'-fluorophenoxy benzaldehyde,4-4-fluoro-phenoxy-benzaldehyde,benzaldehyde, 4-4-fluorophenoxy,pubchem23015,acmc-209ceq,yupbwhurnlrzql-uhfffaoysa,4-4-fluorophenoxyl benzaldehyde,4-fluoro-4'-formyldiphenyl ether |
| IUPAC Name | 4-(4-fluorophenoxy)benzaldehyde |
| InChI Key | YUPBWHURNLRZQL-UHFFFAOYSA-N |
| Molecular Formula | C13H9FO2 |
4-n-Octyloxyphenol 98.0+%, TCI America™
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CAS: 3780-50-5 Molecular Formula: C14H22O2 Molecular Weight (g/mol): 222.328 MDL Number: MFCD00045779 InChI Key: HFRUPPHPJRZOCM-UHFFFAOYSA-N Synonym: 4-octyloxy phenol,4-n-octyloxy phenol,4-n-octyloxyphenol,phenol, 4-octyloxy,4-octyloxyphenol,p-octyloxyphenol,p-octyloxy phenol,4-n-octoxyphenol,pubchem13211,acmc-209ivj PubChem CID: 77412 IUPAC Name: 4-octoxyphenol SMILES: CCCCCCCCOC1=CC=C(C=C1)O
| PubChem CID | 77412 |
|---|---|
| CAS | 3780-50-5 |
| Molecular Weight (g/mol) | 222.328 |
| MDL Number | MFCD00045779 |
| SMILES | CCCCCCCCOC1=CC=C(C=C1)O |
| Synonym | 4-octyloxy phenol,4-n-octyloxy phenol,4-n-octyloxyphenol,phenol, 4-octyloxy,4-octyloxyphenol,p-octyloxyphenol,p-octyloxy phenol,4-n-octoxyphenol,pubchem13211,acmc-209ivj |
| IUPAC Name | 4-octoxyphenol |
| InChI Key | HFRUPPHPJRZOCM-UHFFFAOYSA-N |
| Molecular Formula | C14H22O2 |
3-Bromobenzaldehyde 98.0+%, TCI America™
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CAS: 3132-99-8 Molecular Formula: C7H5BrO Molecular Weight (g/mol): 185.02 MDL Number: MFCD00003345 InChI Key: SUISZCALMBHJQX-UHFFFAOYSA-N Synonym: m-bromobenzaldehyde,benzaldehyde, 3-bromo,benzaldehyde, m-bromo,3-bromobenzeldehyde,unii-w0ard2zj82,3-bromo benzaldehyde,3-bromo-benzaldehyde,w0ard2zj82,benzaldehyde, m-bromo-6ci,7ci,8ci,3-bromobenzaidehyde PubChem CID: 76583 IUPAC Name: 3-bromobenzaldehyde SMILES: C1=CC(=CC(=C1)Br)C=O
| PubChem CID | 76583 |
|---|---|
| CAS | 3132-99-8 |
| Molecular Weight (g/mol) | 185.02 |
| MDL Number | MFCD00003345 |
| SMILES | C1=CC(=CC(=C1)Br)C=O |
| Synonym | m-bromobenzaldehyde,benzaldehyde, 3-bromo,benzaldehyde, m-bromo,3-bromobenzeldehyde,unii-w0ard2zj82,3-bromo benzaldehyde,3-bromo-benzaldehyde,w0ard2zj82,benzaldehyde, m-bromo-6ci,7ci,8ci,3-bromobenzaidehyde |
| IUPAC Name | 3-bromobenzaldehyde |
| InChI Key | SUISZCALMBHJQX-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrO |
o-Anisic Acid 98.0+%, TCI America™
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CAS: 579-75-9 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002431 InChI Key: ILUJQPXNXACGAN-UHFFFAOYSA-N Synonym: o-anisic acid,o-methoxybenzoic acid,2-anisic acid,o-methylsalicylic acid,benzoic acid, 2-methoxy,salicylic acid methyl ether,2-methoxy-benzoic acid,2-methoxybenzoicacid,o-methoxy benzoic acid,ortho-methoxybenzoic acid PubChem CID: 11370 ChEBI: CHEBI:421840 IUPAC Name: 2-methoxybenzoic acid SMILES: COC1=CC=CC=C1C(=O)O
| PubChem CID | 11370 |
|---|---|
| CAS | 579-75-9 |
| Molecular Weight (g/mol) | 152.149 |
| ChEBI | CHEBI:421840 |
| MDL Number | MFCD00002431 |
| SMILES | COC1=CC=CC=C1C(=O)O |
| Synonym | o-anisic acid,o-methoxybenzoic acid,2-anisic acid,o-methylsalicylic acid,benzoic acid, 2-methoxy,salicylic acid methyl ether,2-methoxy-benzoic acid,2-methoxybenzoicacid,o-methoxy benzoic acid,ortho-methoxybenzoic acid |
| IUPAC Name | 2-methoxybenzoic acid |
| InChI Key | ILUJQPXNXACGAN-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
(3R,4R)-1-Benzyl-4-hydroxy-3-pyrrolidinemethanol 96.0+%, TCI America™
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CAS: 253129-03-2 Molecular Formula: C12H17NO2 Molecular Weight (g/mol): 207.273 InChI Key: XQYUBSUGHRDQSN-NEPJUHHUSA-N PubChem CID: 11579361 IUPAC Name: (3R,4R)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-ol SMILES: C1C(C(CN1CC2=CC=CC=C2)O)CO
| PubChem CID | 11579361 |
|---|---|
| CAS | 253129-03-2 |
| Molecular Weight (g/mol) | 207.273 |
| SMILES | C1C(C(CN1CC2=CC=CC=C2)O)CO |
| IUPAC Name | (3R,4R)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-ol |
| InChI Key | XQYUBSUGHRDQSN-NEPJUHHUSA-N |
| Molecular Formula | C12H17NO2 |
Methyl Phenoxyacetate 99.0+%, TCI America™
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CAS: 2065-23-8 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00010227 InChI Key: BZCKRPHEZOHHBK-UHFFFAOYSA-N Synonym: methyl phenoxyacetate,phenoxyacetic acid methyl ester,acetic acid, phenoxy-, methyl ester,methylphenoxyacetate,unii-jd9of3328o,phenoxy methyl acetate,methyl phenoxy acetate,phenoxyacetic acid methyl,acetic acid, 2-phenoxy-, methyl ester,pubchem12489 PubChem CID: 16365 IUPAC Name: methyl 2-phenoxyacetate SMILES: COC(=O)COC1=CC=CC=C1
| PubChem CID | 16365 |
|---|---|
| CAS | 2065-23-8 |
| Molecular Weight (g/mol) | 166.176 |
| MDL Number | MFCD00010227 |
| SMILES | COC(=O)COC1=CC=CC=C1 |
| Synonym | methyl phenoxyacetate,phenoxyacetic acid methyl ester,acetic acid, phenoxy-, methyl ester,methylphenoxyacetate,unii-jd9of3328o,phenoxy methyl acetate,methyl phenoxy acetate,phenoxyacetic acid methyl,acetic acid, 2-phenoxy-, methyl ester,pubchem12489 |
| IUPAC Name | methyl 2-phenoxyacetate |
| InChI Key | BZCKRPHEZOHHBK-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
2,4,6-Tribromoanisole 98.0+%, TCI America™
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CAS: 607-99-8 Molecular Formula: C7H5Br3O Molecular Weight (g/mol): 344.83 MDL Number: MFCD00192510 InChI Key: YXTRCOAFNXQTKL-UHFFFAOYSA-N Synonym: 2,4,6-tribromoanisole,anisole, 2,4,6-tribromo,benzene, 1,3,5-tribromo-2-methoxy,unii-do7m3m4lx5,1,3,5-tribromo-2-methoxy-benzene,methyl 2,4,6-tribromophenyl ether,do7m3m4lx5,2,6-tribromoanisole,anisole,4,6-tribromo,acmc-209mm5 PubChem CID: 11839 IUPAC Name: 1,3,5-tribromo-2-methoxybenzene SMILES: COC1=C(Br)C=C(Br)C=C1Br
| PubChem CID | 11839 |
|---|---|
| CAS | 607-99-8 |
| Molecular Weight (g/mol) | 344.83 |
| MDL Number | MFCD00192510 |
| SMILES | COC1=C(Br)C=C(Br)C=C1Br |
| Synonym | 2,4,6-tribromoanisole,anisole, 2,4,6-tribromo,benzene, 1,3,5-tribromo-2-methoxy,unii-do7m3m4lx5,1,3,5-tribromo-2-methoxy-benzene,methyl 2,4,6-tribromophenyl ether,do7m3m4lx5,2,6-tribromoanisole,anisole,4,6-tribromo,acmc-209mm5 |
| IUPAC Name | 1,3,5-tribromo-2-methoxybenzene |
| InChI Key | YXTRCOAFNXQTKL-UHFFFAOYSA-N |
| Molecular Formula | C7H5Br3O |
Benzyl 3-Bromopropyl Ether 95.0+%, TCI America™
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CAS: 54314-84-0 Molecular Formula: C10H13BrO Molecular Weight (g/mol): 229.12 MDL Number: MFCD00134570 InChI Key: PSUXTZLDBVEZTD-UHFFFAOYSA-N Synonym: benzyl 3-bromopropyl ether,3-bromopropoxy methyl benzene,3-bromopropylbenzyl ether,3-benzyloxy-1-bromopropane,3-benzyloxy propyl bromide,benzene, 3-bromopropoxy methyl,1-3-bromopropoxy methyl benzene,benzyl3-bromopropylether PubChem CID: 2776064 IUPAC Name: [(3-bromopropoxy)methyl]benzene SMILES: BrCCCOCC1=CC=CC=C1
| PubChem CID | 2776064 |
|---|---|
| CAS | 54314-84-0 |
| Molecular Weight (g/mol) | 229.12 |
| MDL Number | MFCD00134570 |
| SMILES | BrCCCOCC1=CC=CC=C1 |
| Synonym | benzyl 3-bromopropyl ether,3-bromopropoxy methyl benzene,3-bromopropylbenzyl ether,3-benzyloxy-1-bromopropane,3-benzyloxy propyl bromide,benzene, 3-bromopropoxy methyl,1-3-bromopropoxy methyl benzene,benzyl3-bromopropylether |
| IUPAC Name | [(3-bromopropoxy)methyl]benzene |
| InChI Key | PSUXTZLDBVEZTD-UHFFFAOYSA-N |
| Molecular Formula | C10H13BrO |
2-(3-Ethoxy-4-ethoxycarbonylphenyl)acetic Acid 98.0+%, TCI America™
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CAS: 99469-99-5 Molecular Formula: C13H16O5 Molecular Weight (g/mol): 252.266 MDL Number: MFCD08704233 InChI Key: OTGSESBEJUHCES-UHFFFAOYSA-N Synonym: Ethyl 4-Carboxymethyl-2-ethoxybenzoate, 4-Carboxymethyl-2-ethoxybenzoic Acid Ethyl Ester PubChem CID: 10131212 IUPAC Name: 2-(3-ethoxy-4-ethoxycarbonylphenyl)acetic acid SMILES: CCOC1=C(C=CC(=C1)CC(=O)O)C(=O)OCC
| PubChem CID | 10131212 |
|---|---|
| CAS | 99469-99-5 |
| Molecular Weight (g/mol) | 252.266 |
| MDL Number | MFCD08704233 |
| SMILES | CCOC1=C(C=CC(=C1)CC(=O)O)C(=O)OCC |
| Synonym | Ethyl 4-Carboxymethyl-2-ethoxybenzoate, 4-Carboxymethyl-2-ethoxybenzoic Acid Ethyl Ester |
| IUPAC Name | 2-(3-ethoxy-4-ethoxycarbonylphenyl)acetic acid |
| InChI Key | OTGSESBEJUHCES-UHFFFAOYSA-N |
| Molecular Formula | C13H16O5 |
3,5-Bis(trifluoromethyl)-2-chloroaniline 98.0+%, TCI America™
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CAS: 201593-90-0 Molecular Formula: C8H4ClF6N Molecular Weight (g/mol): 263.567 InChI Key: JKUFETFGEJPHEM-UHFFFAOYSA-N Synonym: 2-chloro-3,5-bis trifluoromethyl aniline,3,5-bis trifluoromethyl-2-chloroaniline,2-chloro-3,5-bis-trifluoromethyl aniline,benzenamine, 2-chloro-3,5-bis trifluoromethyl,3,5-bis trifluoromethyl-2-chlorophenylamine,pubchem2938,2-chloro-3,5-bis-trifluoromethyl-aniline,3,5-bis trifluoromethyl-2-chloro aniline,2-chloranyl-3,5-bis trifluoromethyl aniline,2-chloro-3,5-bis-trifluoromethyl-phenylamine PubChem CID: 2757429 IUPAC Name: 2-chloro-3,5-bis(trifluoromethyl)aniline SMILES: C1=C(C=C(C(=C1C(F)(F)F)Cl)N)C(F)(F)F
| PubChem CID | 2757429 |
|---|---|
| CAS | 201593-90-0 |
| Molecular Weight (g/mol) | 263.567 |
| SMILES | C1=C(C=C(C(=C1C(F)(F)F)Cl)N)C(F)(F)F |
| Synonym | 2-chloro-3,5-bis trifluoromethyl aniline,3,5-bis trifluoromethyl-2-chloroaniline,2-chloro-3,5-bis-trifluoromethyl aniline,benzenamine, 2-chloro-3,5-bis trifluoromethyl,3,5-bis trifluoromethyl-2-chlorophenylamine,pubchem2938,2-chloro-3,5-bis-trifluoromethyl-aniline,3,5-bis trifluoromethyl-2-chloro aniline,2-chloranyl-3,5-bis trifluoromethyl aniline,2-chloro-3,5-bis-trifluoromethyl-phenylamine |
| IUPAC Name | 2-chloro-3,5-bis(trifluoromethyl)aniline |
| InChI Key | JKUFETFGEJPHEM-UHFFFAOYSA-N |
| Molecular Formula | C8H4ClF6N |
Phenylazoresorcinol 80.0+%, TCI America™
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CAS: 67503-46-2 Molecular Formula: C18H14N2O4 Molecular Weight (g/mol): 322.32 MDL Number: MFCD00059881 InChI Key: KVQRGKQWGHNYJE-FMQUCBEESA-N PubChem CID: 77519172 IUPAC Name: 3-[(E)-(3-hydroxyphenoxy)diazenyl]oxy-2-phenylphenol SMILES: C1=CC=C(C=C1)C2=C(C=CC=C2ON=NOC3=CC=CC(=C3)O)O
| PubChem CID | 77519172 |
|---|---|
| CAS | 67503-46-2 |
| Molecular Weight (g/mol) | 322.32 |
| MDL Number | MFCD00059881 |
| SMILES | C1=CC=C(C=C1)C2=C(C=CC=C2ON=NOC3=CC=CC(=C3)O)O |
| IUPAC Name | 3-[(E)-(3-hydroxyphenoxy)diazenyl]oxy-2-phenylphenol |
| InChI Key | KVQRGKQWGHNYJE-FMQUCBEESA-N |
| Molecular Formula | C18H14N2O4 |
4-Methoxy-3-nitrobenzotrifluoride, TCI America™
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CAS: 394-25-2 Molecular Formula: C8H6F3NO3 Molecular Weight (g/mol): 221.135 MDL Number: MFCD00007099 InChI Key: MAAFHLOZHBKYTG-UHFFFAOYSA-N Synonym: 4-methoxy-3-nitrobenzotrifluoride,1-methoxy-2-nitro-4-trifluoromethyl benzene,2-nitro-4-trifluoromethyl anisole,2-nitro-4-trifluoromethylanisole,3-nitro-4-methoxybenzotrifluoride,4-trifluoromethyl-2-nitroanisole,benzene, 1-methoxy-2-nitro-4-trifluoromethyl,4-trifluoromethyl-1-methoxy-2-nitrobenzene,pubchem13493,4-methoxy-3-nitrobezotrifluoride PubChem CID: 96748 IUPAC Name: 1-methoxy-2-nitro-4-(trifluoromethyl)benzene SMILES: COC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-]
| PubChem CID | 96748 |
|---|---|
| CAS | 394-25-2 |
| Molecular Weight (g/mol) | 221.135 |
| MDL Number | MFCD00007099 |
| SMILES | COC1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-] |
| Synonym | 4-methoxy-3-nitrobenzotrifluoride,1-methoxy-2-nitro-4-trifluoromethyl benzene,2-nitro-4-trifluoromethyl anisole,2-nitro-4-trifluoromethylanisole,3-nitro-4-methoxybenzotrifluoride,4-trifluoromethyl-2-nitroanisole,benzene, 1-methoxy-2-nitro-4-trifluoromethyl,4-trifluoromethyl-1-methoxy-2-nitrobenzene,pubchem13493,4-methoxy-3-nitrobezotrifluoride |
| IUPAC Name | 1-methoxy-2-nitro-4-(trifluoromethyl)benzene |
| InChI Key | MAAFHLOZHBKYTG-UHFFFAOYSA-N |
| Molecular Formula | C8H6F3NO3 |
2-Bromo-4-fluoroanisole 98.0+%, TCI America™
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CAS: 452-08-4 Molecular Formula: C7H6BrFO Molecular Weight (g/mol): 205.03 MDL Number: MFCD00012014 InChI Key: JIQXVIJARQLCOY-UHFFFAOYSA-N Synonym: 2-bromo-4-fluoroanisole,benzene, 2-bromo-4-fluoro-1-methoxy,2-bromo-4-fluoro anisole,1-bromo-3-fluoro-6-methoxybenzene,2-bromo-4-fluoro-methoxybenzene,2-bromo-4-fluoro-1-methoxy-benzene,1-bromo-5-fluoro-2-methoxybenzene,attercop-chm at106665,pubchem1972,2-bromo-4-fluoroanisol PubChem CID: 136292 IUPAC Name: 2-bromo-4-fluoro-1-methoxybenzene SMILES: COC1=CC=C(F)C=C1Br
| PubChem CID | 136292 |
|---|---|
| CAS | 452-08-4 |
| Molecular Weight (g/mol) | 205.03 |
| MDL Number | MFCD00012014 |
| SMILES | COC1=CC=C(F)C=C1Br |
| Synonym | 2-bromo-4-fluoroanisole,benzene, 2-bromo-4-fluoro-1-methoxy,2-bromo-4-fluoro anisole,1-bromo-3-fluoro-6-methoxybenzene,2-bromo-4-fluoro-methoxybenzene,2-bromo-4-fluoro-1-methoxy-benzene,1-bromo-5-fluoro-2-methoxybenzene,attercop-chm at106665,pubchem1972,2-bromo-4-fluoroanisol |
| IUPAC Name | 2-bromo-4-fluoro-1-methoxybenzene |
| InChI Key | JIQXVIJARQLCOY-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrFO |
2-Bromo-1-fluoro-4-nitrobenzene 95.0+%, TCI America™
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CAS: 701-45-1 Molecular Formula: C6H3BrFNO2 Molecular Weight (g/mol): 219.997 MDL Number: MFCD00055433 InChI Key: FAWMTDSAMOCUAR-UHFFFAOYSA-N Synonym: 3-bromo-4-fluoronitrobenzene,1-bromo-2-fluoro-5-nitrobenzene,3-bromo-4-fluoro-1-nitrobenzene,2-bromo-1-fluoro-4-nitro-benzene,2-bromo-4-nitrofluorobenzene,benzene, 2-bromo-1-fluoro-4-nitro,pubchem8499,acmc-1birt,3-bromo-4-fluoronitrobezene,ksc494c7t PubChem CID: 69699 IUPAC Name: 2-bromo-1-fluoro-4-nitrobenzene SMILES: C1=CC(=C(C=C1[N+](=O)[O-])Br)F
| PubChem CID | 69699 |
|---|---|
| CAS | 701-45-1 |
| Molecular Weight (g/mol) | 219.997 |
| MDL Number | MFCD00055433 |
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])Br)F |
| Synonym | 3-bromo-4-fluoronitrobenzene,1-bromo-2-fluoro-5-nitrobenzene,3-bromo-4-fluoro-1-nitrobenzene,2-bromo-1-fluoro-4-nitro-benzene,2-bromo-4-nitrofluorobenzene,benzene, 2-bromo-1-fluoro-4-nitro,pubchem8499,acmc-1birt,3-bromo-4-fluoronitrobezene,ksc494c7t |
| IUPAC Name | 2-bromo-1-fluoro-4-nitrobenzene |
| InChI Key | FAWMTDSAMOCUAR-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrFNO2 |
3-Fluoro-4'-propyl-4-biphenylboronic Acid (contains varying amounts of Anhydride), TCI America™
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| PubChem CID | 53402576 |
|---|---|
| CAS | 909709-42-8 |
| MDL Number | MFCD10687198 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| TSCA | No |
| InChI Key | XZGCBSYWWZAXRC-UHFFFAOYSA-N |
| Molecular Formula | C15H16BFO2 |
| Formula Weight | 258.10 |