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158984-76-0 | 4-Pyridinemethanol, 1,2,3,6-tetrahydro-1-(phenylmethyl)-
CAS No: 158984-76-0 Catalog No: AG001R28 MDL No:MFCD16620244
Product Description
Catalog Number:
AG001R28
Chemical Name:
4-Pyridinemethanol, 1,2,3,6-tetrahydro-1-(phenylmethyl)-
CAS Number:
158984-76-0
Molecular Formula:
C13H17NO
Molecular Weight:
203.2802
MDL Number:
MFCD16620244
IUPAC Name:
(1-benzyl-3,6-dihydro-2H-pyridin-4-yl)methanol
InChI:
InChI=1S/C13H17NO/c15-11-13-6-8-14(9-7-13)10-12-4-2-1-3-5-12/h1-6,15H,7-11H2
InChI Key:
KWEISZMWJPDOFR-UHFFFAOYSA-N
SMILES:
OCC1=CCN(CC1)Cc1ccccc1
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.285g/mol
Monoisotopic Mass:
203.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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