Methyl 5-amino-4-bromo-2-chlorobenzoate
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Basic information
- CAS
1232505-83-7- Standard SMILES
COC(=O)c1cc(N)c(Br)cc1Cl- InChIKey
DTXCBLNBOPMFJS-UHFFFAOYSA-N- Molecular formula
- C8H7BrClNO2
- Average molar mass
- 264.5 g/mol
- Monoisotopic mass
- 262.93487
Names & identifiers
- Preferred name
- Methyl 5-amino-4-bromo-2-chlorobenzoate
- IUPAC
- methyl 5-amino-4-bromo-2-chlorobenzoate
- English name
- 5-AMino-4-broMo-2-chloro-benzoic acid Methyl ester
- Molecular formula
- C8H7BrClNO2
- Molecular weight
- 264.5
Names & synonyms
methyl 5-amino-4-bromo-2-chlorobenzoate1232505-83-75-amino-4-bromo-2-chloro-benzoic acid methyl esterMFCD17168723SCHEMBL3340065SCHEMBL31546995DTXCBLNBOPMFJS-UHFFFAOYSA-NAKOS012323120CS-16602methyl 5-amino-4-bromo-2-chloro-benzoateDB-417442CS-0101201
Show more names
D761472-chloro-4-bromo-5-aminobenzoic acid methyl esterF616769Benzoic acid, 5-amino-4-bromo-2-chloro-, methyl ester
Database identifiers
- CAS
1232505-83-7- PubChem CID
- 59377975
Properties
Computed structural propertiesFilling in
- XLogP
- 2.4
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 203
Physicochemical properties
- storage temp.
- 2 · 2-8°C, protect from light
- Appearance
- White to off-white Solid
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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