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Home > Other Heterocycles > 875-16-1
875-16-1 | 1-(propan-2-yl)-3-oxabicyclo[3.1.0]hexane-2,4-dione
CAS No: 875-16-1 Catalog No: AG01BJ1L MDL No:MFCD24501389
Product Description
Catalog Number:
AG01BJ1L
Chemical Name:
1-(propan-2-yl)-3-oxabicyclo[3.1.0]hexane-2,4-dione
CAS Number:
875-16-1
Molecular Formula:
C8H10O3
Molecular Weight:
154.1632
MDL Number:
MFCD24501389
IUPAC Name:
1-propan-2-yl-3-oxabicyclo[3.1.0]hexane-2,4-dione
InChI:
InChI=1S/C8H10O3/c1-4(2)8-3-5(8)6(9)11-7(8)10/h4-5H,3H2,1-2H3
InChI Key:
AWMMNTQOXJVBOX-UHFFFAOYSA-N
SMILES:
CC(C12CC2C(=O)OC1=O)C
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.063g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.165g/mol
Monoisotopic Mass:
154.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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