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Home > Imidazoles > 1033693-17-2
1033693-17-2 | 4-(1H-imidazol-1-ylmethyl)-4-piperidinol
CAS No: 1033693-17-2 Catalog No: AG00J1ZV MDL No:MFCD10686633
Product Description
Catalog Number:
AG00J1ZV
Chemical Name:
4-(1H-imidazol-1-ylmethyl)-4-piperidinol
CAS Number:
1033693-17-2
MDL Number:
MFCD10686633
IUPAC Name:
4-(imidazol-1-ylmethyl)piperidin-4-ol
InChI:
InChI=1S/C9H15N3O/c13-9(1-3-10-4-2-9)7-12-6-5-11-8-12/h5-6,8,10,13H,1-4,7H2
InChI Key:
LUDVFFBKGBACJW-UHFFFAOYSA-N
SMILES:
OC1(CCNCC1)Cn1cncc1
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.122g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
181.239g/mol
Monoisotopic Mass:
181.122g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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