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939986-40-0 | (1-Pyridin-2-ylMethyl-piperidin-3-yl)-Methanol, 98+% C12H18N2O, MW
CAS No: 939986-40-0 Catalog No: AG00H1HB MDL No:MFCD09607583
Product Description
Catalog Number:
AG00H1HB
Chemical Name:
(1-Pyridin-2-ylMethyl-piperidin-3-yl)-Methanol, 98+% C12H18N2O, MW
CAS Number:
939986-40-0
Molecular Formula:
C12H18N2O
Molecular Weight:
206.2841
MDL Number:
MFCD09607583
IUPAC Name:
[1-(pyridin-2-ylmethyl)piperidin-3-yl]methanol
InChI:
InChI=1S/C12H18N2O/c15-10-11-4-3-7-14(8-11)9-12-5-1-2-6-13-12/h1-2,5-6,11,15H,3-4,7-10H2
InChI Key:
IISDRBUMWAGCNB-UHFFFAOYSA-N
SMILES:
OCC1CCCN(C1)Cc1ccccn1
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.142g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.289g/mol
Monoisotopic Mass:
206.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
36.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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