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Home > Other Heterocycles > 194421-56-2
194421-56-2 | 3-Azabicyclo[3.1.0]hexane-2,4-dione, 6,6-dimethyl-
CAS No: 194421-56-2 Catalog No: AG00I326 MDL No:MFCD12923551
Product Description
Catalog Number:
AG00I326
Chemical Name:
3-Azabicyclo[3.1.0]hexane-2,4-dione, 6,6-dimethyl-
CAS Number:
194421-56-2
Molecular Formula:
C7H9NO2
Molecular Weight:
139.1519
MDL Number:
MFCD12923551
IUPAC Name:
6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2,4-dione
InChI:
InChI=1S/C7H9NO2/c1-7(2)3-4(7)6(10)8-5(3)9/h3-4H,1-2H3,(H,8,9,10)
InChI Key:
DRMNZTFLOOSXIN-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C2C1C2(C)C
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.063g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
139.154g/mol
Monoisotopic Mass:
139.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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