Basic information
- CAS
1935921-64-4- Standard SMILES
COC(=O)c1c(F)cc(Br)cc1CBr- InChIKey
VENBTJVAHMHJJX-UHFFFAOYSA-N- Molecular formula
- C9H7Br2FO2
- Average molar mass
- 325.96 g/mol
- Monoisotopic mass
- 323.87968
Names & identifiers
- Preferred name
- Methyl 4-bromo-2-(bromomethyl)-6-fluorobenzoate
- IUPAC
- methyl 4-bromo-2-(bromomethyl)-6-fluorobenzoate
- English name
- Benzoic acid, 4-bromo-2-(bromomethyl)-6-fluoro-, methyl ester
- Molecular formula
- C9H7Br2FO2
- Molecular weight
- 325.96
Names & synonyms
Methyl 4-bromo-2-(bromomethyl)-6-fluorobenzoate1935921-64-4MFCD29760551SCHEMBL18786916SCHEMBL40840899WLZ4178FAA35253AT12503BS-52304SY332089DB-209337Methyl4-bromo-2-(bromomethyl)-6-fluorobenzoate
Show more names
F7874054-Bromo-2-bromomethyl-6-fluoro-benzoic acid methyl esterBenzoic acid, 4-bromo-2-(bromomethyl)-6-fluoro-, methyl ester
Database identifiers
- CAS
1935921-64-4- PubChem CID
- 92133056
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 213
Physicochemical properties
- Boiling point
- 367.7 · 367.7±42.0 °C(Predicted)
- Density
- 1.839 · 1.839±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Storage temp. 2-8°C
- Appearance
- Colorless to off-white Solid-Liquid Mixture
Chemistry & industry
Suppliers25 total
南京优氟医药科技有限公司025-86755008 17751752005 · [email protected]
常州稀亚生物科技有限公司13775267187 · [email protected]
石家庄衍晟生物科技有限公司18332018567; 18332018567 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
苏州亚衍医药科技有限公司17715136450 · [email protected]
济南德迈医药科技有限公司18669728830 15806766175 · [email protected]
Zhejiang J&C Biological Technology Co.,Limited+1-2135480471 · [email protected]
台州南峰药物研究所[email protected] 13127117265 · [email protected]
青岛海智微元生物科技有限公司18317699790 18317699790 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
成都沸柏医药科技有限公司028-84641798 18782128315 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
上海林栎生物科技有限公司13761635123 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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