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Home > Other Heterocycles > 866825-07-2
866825-07-2 | 3-Oxabicyclo[3.1.0]hexan-2-one, 4-ethenyl-4-methyl-, (1S,5R)-
CAS No: 866825-07-2 Catalog No: AG004TCS MDL No:
Product Description
Catalog Number:
AG004TCS
Chemical Name:
3-Oxabicyclo[3.1.0]hexan-2-one, 4-ethenyl-4-methyl-, (1S,5R)-
CAS Number:
866825-07-2
Molecular Formula:
C8H10O2
Molecular Weight:
138.1638
IUPAC Name:
(1S,5R)-4-ethenyl-4-methyl-3-oxabicyclo[3.1.0]hexan-2-one
InChI:
InChI=1S/C8H10O2/c1-3-8(2)6-4-5(6)7(9)10-8/h3,5-6H,1,4H2,2H3/t5-,6+,8?/m0/s1
InChI Key:
OSZJKOLUTLRMTF-FWHJPCMOSA-N
SMILES:
CC1(OC(=O)[C@@H]2[C@H]1C2)C=C
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
138.068g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.166g/mol
Monoisotopic Mass:
138.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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