Home Halogens methyl 5-amino-2-bromobenzoate hydrochloride

methyl 5-amino-2-bromobenzoate hydrochloride

CAS No.:
1803581-93-2
Catalog Number:
AG01AG48
Molecular Formula:
C8H9BrClNO2
Molecular Weight:
266.5196
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Product Description
Catalog Number:
AG01AG48
Chemical Name:
methyl 5-amino-2-bromobenzoate hydrochloride
CAS Number:
1803581-93-2
Molecular Formula:
C8H9BrClNO2
Molecular Weight:
266.5196
MDL Number:
MFCD27920330
IUPAC Name:
methyl 5-amino-2-bromobenzoate;hydrochloride
InChI:
InChI=1S/C8H8BrNO2.ClH/c1-12-8(11)6-4-5(10)2-3-7(6)9;/h2-4H,10H2,1H3;1H
InChI Key:
XOLXPFZLNOUDGV-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(N)ccc1Br.Cl
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.951g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
266.519g/mol
Monoisotopic Mass:
264.951g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties