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2172541-00-1 | 2-methyl-2-(1-methyl-1H-imidazol-2-yl)propanoic acid hydrochloride
CAS No: 2172541-00-1 Catalog No: AG01FK5B MDL No:
Product Description
Catalog Number:
AG01FK5B
Chemical Name:
2-methyl-2-(1-methyl-1H-imidazol-2-yl)propanoic acid hydrochloride
CAS Number:
2172541-00-1
Molecular Formula:
C8H13ClN2O2
Molecular Weight:
204.6540
IUPAC Name:
2-methyl-2-(1-methylimidazol-2-yl)propanoic acid;hydrochloride
InChI:
InChI=1S/C8H12N2O2.ClH/c1-8(2,7(11)12)6-9-4-5-10(6)3;/h4-5H,1-3H3,(H,11,12);1H
InChI Key:
AZBNSONJCMECRL-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1nccn1C)(C)C.Cl
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
204.654g/mol
Monoisotopic Mass:
204.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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