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Home Halogens methyl 2-amino-4-bromo-5-fluorobenzoate hydrochloride

methyl 2-amino-4-bromo-5-fluorobenzoate hydrochloride

CAS No.:
1803567-02-3
Catalog Number:
AG01BGWJ
Molecular Formula:
C8H8BrClFNO2
Molecular Weight:
284.5100
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Product Description
Catalog Number:
AG01BGWJ
Chemical Name:
methyl 2-amino-4-bromo-5-fluorobenzoate hydrochloride
CAS Number:
1803567-02-3
Molecular Formula:
C8H8BrClFNO2
Molecular Weight:
284.5100
MDL Number:
MFCD28125284
IUPAC Name:
methyl 2-amino-4-bromo-5-fluorobenzoate;hydrochloride
InChI:
InChI=1S/C8H7BrFNO2.ClH/c1-13-8(12)4-2-6(10)5(9)3-7(4)11;/h2-3H,11H2,1H3;1H
InChI Key:
NKAAVNNPIUVHSE-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(F)c(cc1N)Br.Cl
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.941g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
284.509g/mol
Monoisotopic Mass:
282.941g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties