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287953-38-2 | Carbamic acid, N-[1-(methylsulfonyl)-4-piperidinyl]-, 1,1-dimethylethyl ester
CAS No: 287953-38-2 Catalog No: AG002WII MDL No:MFCD11852586
Product Description
Catalog Number:
AG002WII
Chemical Name:
Carbamic acid, N-[1-(methylsulfonyl)-4-piperidinyl]-, 1,1-dimethylethyl ester
CAS Number:
287953-38-2
Molecular Formula:
C11H22N2O4S
Molecular Weight:
278.3684
MDL Number:
MFCD11852586
IUPAC Name:
tert-butyl N-(1-methylsulfonylpiperidin-4-yl)carbamate
InChI:
InChI=1S/C11H22N2O4S/c1-11(2,3)17-10(14)12-9-5-7-13(8-6-9)18(4,15)16/h9H,5-8H2,1-4H3,(H,12,14)
InChI Key:
BVSNHVUSSUREGZ-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CCN(CC1)S(=O)(=O)C
Properties
Complexity:
386
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.13g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.367g/mol
Monoisotopic Mass:
278.13g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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