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1281924-78-4 | Carbamic acid, N-[2-methyl-1-(phenylmethyl)-4-piperidinyl]-, 1,1-dimethylethyl ester
CAS No: 1281924-78-4 Catalog No: AG000XU5 MDL No:MFCD16497008
Product Description
Catalog Number:
AG000XU5
Chemical Name:
Carbamic acid, N-[2-methyl-1-(phenylmethyl)-4-piperidinyl]-, 1,1-dimethylethyl ester
CAS Number:
1281924-78-4
Molecular Formula:
C18H28N2O2
Molecular Weight:
304.4271
MDL Number:
MFCD16497008
IUPAC Name:
tert-butyl N-(1-benzyl-2-methylpiperidin-4-yl)carbamate
InChI:
InChI=1S/C18H28N2O2/c1-14-12-16(19-17(21)22-18(2,3)4)10-11-20(14)13-15-8-6-5-7-9-15/h5-9,14,16H,10-13H2,1-4H3,(H,19,21)
InChI Key:
BHAZFVKFDSYPHD-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CCN(C(C1)C)Cc1ccccc1
Properties
Complexity:
359
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.215g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
304.434g/mol
Monoisotopic Mass:
304.215g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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