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2044797-07-9 | 1-cyclopropyl-1H-imidazole-4-carboxylic acid hydrochloride
CAS No: 2044797-07-9 Catalog No: AG01BVH7 MDL No:MFCD30476411
Product Description
Catalog Number:
AG01BVH7
Chemical Name:
1-cyclopropyl-1H-imidazole-4-carboxylic acid hydrochloride
CAS Number:
2044797-07-9
Molecular Formula:
C7H9ClN2O2
Molecular Weight:
188.6116
MDL Number:
MFCD30476411
IUPAC Name:
1-cyclopropylimidazole-4-carboxylic acid;hydrochloride
InChI:
InChI=1S/C7H8N2O2.ClH/c10-7(11)6-3-9(4-8-6)5-1-2-5;/h3-5H,1-2H2,(H,10,11);1H
InChI Key:
WFTCNHZCOOHRLX-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncn(c1)C1CC1.Cl
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.035g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
188.611g/mol
Monoisotopic Mass:
188.035g/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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