Home Carboxys 2-(propan-2-yl)-1H-imidazole-4-carboxylic acid hydrochloride

2-(propan-2-yl)-1H-imidazole-4-carboxylic acid hydrochloride

CAS No.:
775350-26-0
Catalog Number:
AG01AHOM
Molecular Formula:
C7H11ClN2O2
Molecular Weight:
190.6274
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Product Description
Catalog Number:
AG01AHOM
Chemical Name:
2-(propan-2-yl)-1H-imidazole-4-carboxylic acid hydrochloride
CAS Number:
775350-26-0
Molecular Formula:
C7H11ClN2O2
Molecular Weight:
190.6274
MDL Number:
MFCD18838690
IUPAC Name:
2-propan-2-yl-1H-imidazole-5-carboxylic acid;hydrochloride
InChI:
InChI=1S/C7H10N2O2.ClH/c1-4(2)6-8-3-5(9-6)7(10)11;/h3-4H,1-2H3,(H,8,9)(H,10,11);1H
InChI Key:
PQTLZSXXKXMOSJ-UHFFFAOYSA-N
SMILES:
CC(c1[nH]cc(n1)C(=O)O)C.Cl
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.051g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
190.627g/mol
Monoisotopic Mass:
190.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties