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Home > Other Heterocycles > 278-38-6
278-38-6 | 7-Oxabicyclo[4.2.0]octane (6CI,7CI,8CI,9CI)
CAS No: 278-38-6 Catalog No: AG002US8 MDL No:
Product Description
Catalog Number:
AG002US8
Chemical Name:
7-Oxabicyclo[4.2.0]octane (6CI,7CI,8CI,9CI)
CAS Number:
278-38-6
Molecular Formula:
C7H12O
Molecular Weight:
112.1696
IUPAC Name:
7-oxabicyclo[4.2.0]octane
InChI:
InChI=1S/C7H12O/c1-2-4-7-6(3-1)5-8-7/h6-7H,1-5H2
InChI Key:
KDBXRAQKSXYXFU-UHFFFAOYSA-N
SMILES:
C1CCC2C(C1)OC2
NSC Number:
37370
Properties
Complexity:
90.4
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:
9.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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