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1316222-40-8 | 3-[(1-methyl-1H-imidazol-2-yl)methyl]piperidine
CAS No: 1316222-40-8 Catalog No: AG019TNF MDL No:MFCD18381589
Product Description
Catalog Number:
AG019TNF
Chemical Name:
3-[(1-methyl-1H-imidazol-2-yl)methyl]piperidine
CAS Number:
1316222-40-8
Molecular Formula:
C10H17N3
Molecular Weight:
179.2621
MDL Number:
MFCD18381589
IUPAC Name:
3-[(1-methylimidazol-2-yl)methyl]piperidine
InChI:
InChI=1S/C10H17N3/c1-13-6-5-12-10(13)7-9-3-2-4-11-8-9/h5-6,9,11H,2-4,7-8H2,1H3
InChI Key:
BXKXDENMWGGULO-UHFFFAOYSA-N
SMILES:
Cn1ccnc1CC1CCCNC1
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:
0.6
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