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Home > Other Heterocycles > 2138390-08-4
2138390-08-4 | tert-butyl N-{5-oxospiro[2.3]hexan-1-yl}carbamate
CAS No: 2138390-08-4 Catalog No: AG01EJWA MDL No:MFCD31559457
Product Description
Catalog Number:
AG01EJWA
Chemical Name:
tert-butyl N-{5-oxospiro[2.3]hexan-1-yl}carbamate
CAS Number:
2138390-08-4
Molecular Formula:
C11H17NO3
Molecular Weight:
211.2576
MDL Number:
MFCD31559457
IUPAC Name:
tert-butyl N-(5-oxospiro[2.3]hexan-2-yl)carbamate
InChI:
InChI=1S/C11H17NO3/c1-10(2,3)15-9(14)12-8-6-11(8)4-7(13)5-11/h8H,4-6H2,1-3H3,(H,12,14)
InChI Key:
NOHPNCADBPHBEG-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CC21CC(=O)C2
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.121g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.261g/mol
Monoisotopic Mass:
211.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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