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Home > Other Heterocycles > 17612-36-1
17612-36-1 | 7-Oxabicyclo[4.1.0]heptane, 1,6-dimethyl-
CAS No: 17612-36-1 Catalog No: AG0021GB MDL No:
Product Description
Catalog Number:
AG0021GB
Chemical Name:
7-Oxabicyclo[4.1.0]heptane, 1,6-dimethyl-
CAS Number:
17612-36-1
Molecular Formula:
C8H14O
Molecular Weight:
126.1962
IUPAC Name:
1,6-dimethyl-7-oxabicyclo[4.1.0]heptane
InChI:
InChI=1S/C8H14O/c1-7-5-3-4-6-8(7,2)9-7/h3-6H2,1-2H3
InChI Key:
WNEUNPWLVWPBGB-UHFFFAOYSA-N
SMILES:
CC12CCCCC2(O1)C
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.104g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.199g/mol
Monoisotopic Mass:
126.104g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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