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Home > Other Heterocycles > 1638771-32-0
1638771-32-0 | tert-butyl (8-oxobicyclo[3.2.1]octan-3-yl)carbamate
CAS No: 1638771-32-0 Catalog No: AG01AULV MDL No:MFCD27987349
Product Description
Catalog Number:
AG01AULV
Chemical Name:
tert-butyl (8-oxobicyclo[3.2.1]octan-3-yl)carbamate
CAS Number:
1638771-32-0
Molecular Formula:
C13H21NO3
Molecular Weight:
239.3107
MDL Number:
MFCD27987349
IUPAC Name:
tert-butyl N-(8-oxo-3-bicyclo[3.2.1]octanyl)carbamate
InChI:
InChI=1S/C13H21NO3/c1-13(2,3)17-12(16)14-10-6-8-4-5-9(7-10)11(8)15/h8-10H,4-7H2,1-3H3,(H,14,16)
InChI Key:
HLYGBCMBJPUFGL-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CC2CCC(C1)C2=O
Properties
Complexity:
316
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.152g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.315g/mol
Monoisotopic Mass:
239.152g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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