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Home > Imidazoles > 1158410-33-3
1158410-33-3 | 1-(2-methyl-1H-imidazol-1-yl)acetone hydrochloride
CAS No: 1158410-33-3 Catalog No: AG00J1TO MDL No:MFCD15176469
Product Description
Catalog Number:
AG00J1TO
Chemical Name:
1-(2-methyl-1H-imidazol-1-yl)acetone hydrochloride
CAS Number:
1158410-33-3
Molecular Formula:
C7H11ClN2O
Molecular Weight:
174.6280
MDL Number:
MFCD15176469
IUPAC Name:
1-(2-methylimidazol-1-yl)propan-2-one;hydrochloride
InChI:
InChI=1S/C7H10N2O.ClH/c1-6(10)5-9-4-3-8-7(9)2;/h3-4H,5H2,1-2H3;1H
InChI Key:
JAWONSGXDADYFJ-UHFFFAOYSA-N
SMILES:
CC(=O)Cn1ccnc1C.Cl
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.056g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.628g/mol
Monoisotopic Mass:
174.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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