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959237-54-8 | 3-[(2-methyl-1H-imidazol-1-yl)methyl]piperidine
CAS No: 959237-54-8 Catalog No: AG00J1BK MDL No:MFCD09864301
Product Description
Catalog Number:
AG00J1BK
Chemical Name:
3-[(2-methyl-1H-imidazol-1-yl)methyl]piperidine
CAS Number:
959237-54-8
Molecular Formula:
C10H17N3
Molecular Weight:
179.2621
MDL Number:
MFCD09864301
IUPAC Name:
3-[(2-methylimidazol-1-yl)methyl]piperidine
InChI:
InChI=1S/C10H17N3/c1-9-12-5-6-13(9)8-10-3-2-4-11-7-10/h5-6,10-11H,2-4,7-8H2,1H3
InChI Key:
ZBHMTCQCIMNPNR-UHFFFAOYSA-N
SMILES:
Cc1nccn1CC1CCCNC1
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.142g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.267g/mol
Monoisotopic Mass:
179.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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