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157717-58-3 | 2(3H)-Furanone, 3-azidodihydro-4,4-dimethyl-, (3S)-
CAS No: 157717-58-3 Catalog No: AG001PNS MDL No:MFCD11974194
Product Description
Catalog Number:
AG001PNS
Chemical Name:
2(3H)-Furanone, 3-azidodihydro-4,4-dimethyl-, (3S)-
CAS Number:
157717-58-3
Molecular Formula:
C6H9N3O2
Molecular Weight:
155.1546
MDL Number:
MFCD11974194
IUPAC Name:
(3S)-3-azido-4,4-dimethyloxolan-2-one
InChI:
InChI=1S/C6H9N3O2/c1-6(2)3-11-5(10)4(6)8-9-7/h4H,3H2,1-2H3/t4-/m1/s1
InChI Key:
CUPAQOABYPHYPF-SCSAIBSYSA-N
SMILES:
O=C1OCC([C@@H]1N=[N+]=[N-])(C)C
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
155.069g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
155.157g/mol
Monoisotopic Mass:
155.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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