Home Halogens 2-[(4-chlorophenyl)methyl]-1H-imidazole-4-carboxylic acid hydrochloride

2-[(4-chlorophenyl)methyl]-1H-imidazole-4-carboxylic acid hydrochloride

CAS No.:
1803586-66-4
Catalog Number:
AG01BE7T
Molecular Formula:
C11H10Cl2N2O2
Molecular Weight:
273.1153
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Product Description
Catalog Number:
AG01BE7T
Chemical Name:
2-[(4-chlorophenyl)methyl]-1H-imidazole-4-carboxylic acid hydrochloride
CAS Number:
1803586-66-4
Molecular Formula:
C11H10Cl2N2O2
Molecular Weight:
273.1153
MDL Number:
MFCD28118310
IUPAC Name:
2-[(4-chlorophenyl)methyl]-1H-imidazole-5-carboxylic acid;hydrochloride
InChI:
InChI=1S/C11H9ClN2O2.ClH/c12-8-3-1-7(2-4-8)5-10-13-6-9(14-10)11(15)16;/h1-4,6H,5H2,(H,13,14)(H,15,16);1H
InChI Key:
SZVNXLTYSUEGQC-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)Cc1[nH]cc(n1)C(=O)O.Cl
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.012g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
273.113g/mol
Monoisotopic Mass:
272.012g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties