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Home > Imidazoles > 1343342-67-5
1343342-67-5 | 3-(1-methyl-1H-imidazol-2-yl)cyclohexan-1-one
CAS No: 1343342-67-5 Catalog No: AG01BG2J MDL No:MFCD20336516
Product Description
Catalog Number:
AG01BG2J
Chemical Name:
3-(1-methyl-1H-imidazol-2-yl)cyclohexan-1-one
CAS Number:
1343342-67-5
Molecular Formula:
C10H14N2O
Molecular Weight:
178.2310
MDL Number:
MFCD20336516
IUPAC Name:
3-(1-methylimidazol-2-yl)cyclohexan-1-one
InChI:
InChI=1S/C10H14N2O/c1-12-6-5-11-10(12)8-3-2-4-9(13)7-8/h5-6,8H,2-4,7H2,1H3
InChI Key:
AWGHPQAZHCPYFZ-UHFFFAOYSA-N
SMILES:
O=C1CCCC(C1)c1nccn1C
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.111g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.235g/mol
Monoisotopic Mass:
178.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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