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746578-71-2 | Benzyl methyl(piperidin-4-ylmethyl);carbamate
CAS No: 746578-71-2 Catalog No: AG005IHZ MDL No:MFCD08061950
Product Description
Catalog Number:
AG005IHZ
Chemical Name:
Benzyl methyl(piperidin-4-ylmethyl);carbamate
CAS Number:
746578-71-2
Molecular Formula:
C15H22N2O2
Molecular Weight:
262.3474
MDL Number:
MFCD08061950
IUPAC Name:
benzyl N-methyl-N-(piperidin-4-ylmethyl)carbamate
InChI:
InChI=1S/C15H22N2O2/c1-17(11-13-7-9-16-10-8-13)15(18)19-12-14-5-3-2-4-6-14/h2-6,13,16H,7-12H2,1H3
InChI Key:
SXPPVIOGKHFMQQ-UHFFFAOYSA-N
SMILES:
O=C(N(CC1CCNCC1)C)OCc1ccccc1
Properties
Complexity:
271
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.168g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.353g/mol
Monoisotopic Mass:
262.168g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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