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162686-54-6 | 4-Piperidinemethanol, 4-(aminomethyl)-1-(phenylmethyl)-
CAS No: 162686-54-6 Catalog No: AG001TB8 MDL No:MFCD09999243
Product Description
Catalog Number:
AG001TB8
Chemical Name:
4-Piperidinemethanol, 4-(aminomethyl)-1-(phenylmethyl)-
CAS Number:
162686-54-6
Molecular Formula:
C14H22N2O
Molecular Weight:
234.3373
MDL Number:
MFCD09999243
IUPAC Name:
[4-(aminomethyl)-1-benzylpiperidin-4-yl]methanol
InChI:
InChI=1S/C14H22N2O/c15-11-14(12-17)6-8-16(9-7-14)10-13-4-2-1-3-5-13/h1-5,17H,6-12,15H2
InChI Key:
HYQLLESNZAWFCJ-UHFFFAOYSA-N
SMILES:
NCC1(CO)CCN(CC1)Cc1ccccc1
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.173g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
234.343g/mol
Monoisotopic Mass:
234.173g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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