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24647-62-9 | 1H-Imidazole-1-propanoic acid, 2-methyl-
CAS No: 24647-62-9 Catalog No: AG002OX0 MDL No:MFCD00234356
Product Description
Catalog Number:
AG002OX0
Chemical Name:
1H-Imidazole-1-propanoic acid, 2-methyl-
CAS Number:
24647-62-9
Molecular Formula:
C7H10N2O2
Molecular Weight:
154.1665
MDL Number:
MFCD00234356
IUPAC Name:
3-(2-methylimidazol-1-yl)propanoic acid
InChI:
InChI=1S/C7H10N2O2/c1-6-8-3-5-9(6)4-2-7(10)11/h3,5H,2,4H2,1H3,(H,10,11)
InChI Key:
UVICIJVLATWAES-UHFFFAOYSA-N
SMILES:
Cc1nccn1CCC(=O)O
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.169g/mol
Monoisotopic Mass:
154.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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