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Home > Other Heterocycles > 82461-31-2

82461-31-2

82461-31-2 | 6-Oxabicyclo[3.1.0]hexane, 1,5-dimethyl-

CAS No: 82461-31-2 Catalog No: AG0050PT MDL No:

Product Description

Catalog Number:
AG0050PT
Chemical Name:
6-Oxabicyclo[3.1.0]hexane, 1,5-dimethyl-
CAS Number:
82461-31-2
Molecular Formula:
C7H12O
Molecular Weight:
112.1696
IUPAC Name:
1,5-dimethyl-6-oxabicyclo[3.1.0]hexane
InChI:
InChI=1S/C7H12O/c1-6-4-3-5-7(6,2)8-6/h3-5H2,1-2H3
InChI Key:
UXMPPYGRAFYWRK-UHFFFAOYSA-N
SMILES:
CC12CCCC2(O1)C

Properties

Complexity:
118  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.089g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
112.172g/mol
Monoisotopic Mass:
112.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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