Home Halogens 5-chloro-2-(1H-imidazol-1-yl)benzoic acid hydrochloride

5-chloro-2-(1H-imidazol-1-yl)benzoic acid hydrochloride

CAS No.:
1909308-59-3
Catalog Number:
AG01C4CX
Molecular Formula:
C10H8Cl2N2O2
Molecular Weight:
259.0887
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Product Description
Catalog Number:
AG01C4CX
Chemical Name:
5-chloro-2-(1H-imidazol-1-yl)benzoic acid hydrochloride
CAS Number:
1909308-59-3
Molecular Formula:
C10H8Cl2N2O2
Molecular Weight:
259.0887
MDL Number:
MFCD29763100
IUPAC Name:
5-chloro-2-imidazol-1-ylbenzoic acid;hydrochloride
InChI:
InChI=1S/C10H7ClN2O2.ClH/c11-7-1-2-9(8(5-7)10(14)15)13-4-3-12-6-13;/h1-6H,(H,14,15);1H
InChI Key:
XKQSAUMQCBPZJD-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)C(=O)O)n1cncc1.Cl
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.996g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
259.086g/mol
Monoisotopic Mass:
257.996g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties