Home Halogens 4-bromo-2-(dimethylamino)benzoic acid hydrochloride

4-bromo-2-(dimethylamino)benzoic acid hydrochloride

CAS No.:
1209966-33-5
Catalog Number:
AG019XAL
Molecular Formula:
C9H11BrClNO2
Molecular Weight:
280.5461
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Product Description
Catalog Number:
AG019XAL
Chemical Name:
4-bromo-2-(dimethylamino)benzoic acid hydrochloride
CAS Number:
1209966-33-5
Molecular Formula:
C9H11BrClNO2
Molecular Weight:
280.5461
MDL Number:
MFCD13196080
IUPAC Name:
4-bromo-2-(dimethylamino)benzoic acid;hydrochloride
InChI:
InChI=1S/C9H10BrNO2.ClH/c1-11(2)8-5-6(10)3-4-7(8)9(12)13;/h3-5H,1-2H3,(H,12,13);1H
InChI Key:
NYSFCALBEOOINB-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)N(C)C)C(=O)O.Cl
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.966g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
280.546g/mol
Monoisotopic Mass:
278.966g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties