Basic information
- CAS
581812-99-9- Standard SMILES
NCc1ccc(Br)c(F)c1- InChIKey
CVIUPXRJEKIHDP-UHFFFAOYSA-N- Molecular formula
- C7H7BrFN
- Average molar mass
- 204.04 g/mol
- Monoisotopic mass
- 202.97458954
Names & identifiers
- Preferred name
- (4-Bromo-3-fluorophenyl)methanamine
- IUPAC
- (4-bromo-3-fluorophenyl)methanamine
- English name
- (4-bromo-3-fluorophenyl)methanamine
- Molecular formula
- C7H7BrFN
- Molecular weight
- 204.04
Names & synonyms
(4-bromo-3-fluorophenyl)methanamine581812-99-94-Bromo-3-fluorobenzylamineBenzenemethanamine, 4-bromo-3-fluoro-MFCD125461141-(4-Bromo-3-fluorophenyl)methanamineSCHEMBL855443AKOS010971470SB78456AS-43969SY269861EN300-59618
Show more names
4-bromo-3-fluorobenzenemethan amine(4-Bromo-3-fluorophenyl)methanamine - [B89749]
FT-0704640SCHEMBL27901470DTXSID90624951CVIUPXRJEKIHDP-UHFFFAOYSA-N(4-bromo-3-fluoro-phenyl)methanamineDA-39878CS-0134979F618800
Database identifiers
- CAS
581812-99-9- PubChem CID
- 22337664
- DTXSID
DTXSID90624951
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 110
Physicochemical properties
- storage temp.
- 2 · 2-8°C, protect from light
- Appearance
- Colorless to light yellow Solid-liquid mixture
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers51 total
上海康恩博医药科技有限公司17510465506 · [email protected]
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
杭州鸿喜生物医药科技有限公司18989489206 · [email protected]
南京翔睿科技有限公司021-021-00000000 15715199582
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
上海华思格医药科技有限公司13611612777 · [email protected]
上海健超生物科技有限公司150-2103-5486 18017383231 · [email protected]
上海复青化学科技有限公司13816107857 · [email protected]
沧州康瑞医药科技有限公司18632776803
阳谷荣科商贸有限公司15863541132 · [email protected]
Related reactions
4 records
Compound notes
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