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Home > Pyridines > 1134327-87-9
1134327-87-9 | Carbamic acid, N-[4-oxo-4-(3-pyridinyl)butyl]-, 1,1-dimethylethyl ester
CAS No: 1134327-87-9 Catalog No: AG0008KP MDL No:MFCD11858517
Product Description
Catalog Number:
AG0008KP
Chemical Name:
Carbamic acid, N-[4-oxo-4-(3-pyridinyl)butyl]-, 1,1-dimethylethyl ester
CAS Number:
1134327-87-9
Molecular Formula:
C14H20N2O3
Molecular Weight:
264.3202
MDL Number:
MFCD11858517
IUPAC Name:
tert-butyl N-(4-oxo-4-pyridin-3-ylbutyl)carbamate
InChI:
InChI=1S/C14H20N2O3/c1-14(2,3)19-13(18)16-9-5-7-12(17)11-6-4-8-15-10-11/h4,6,8,10H,5,7,9H2,1-3H3,(H,16,18)
InChI Key:
ZTNFKUOAJCTSHW-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCCCC(=O)c1cccnc1
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.325g/mol
Monoisotopic Mass:
264.147g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
68.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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