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182223-53-6

182223-53-6 | Carbamic acid, [1-(phenylmethyl)-4-piperidinyl]-, phenylmethyl ester (9CI)

CAS No: 182223-53-6 Catalog No: AG0023HW MDL No:MFCD16251209

Product Description

Catalog Number:
AG0023HW
Chemical Name:
Carbamic acid, [1-(phenylmethyl)-4-piperidinyl]-, phenylmethyl ester (9CI)
CAS Number:
182223-53-6
Molecular Formula:
C20H24N2O2
Molecular Weight:
324.4168
MDL Number:
MFCD16251209
IUPAC Name:
benzyl N-(1-benzylpiperidin-4-yl)carbamate
InChI:
InChI=1S/C20H24N2O2/c23-20(24-16-18-9-5-2-6-10-18)21-19-11-13-22(14-12-19)15-17-7-3-1-4-8-17/h1-10,19H,11-16H2,(H,21,23)
InChI Key:
VZHJWMOVSNSVSX-UHFFFAOYSA-N
SMILES:
O=C(NC1CCN(CC1)Cc1ccccc1)OCc1ccccc1

Properties

Complexity:
368  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.184g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
324.424g/mol
Monoisotopic Mass:
324.184g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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