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Home > Other Heterocycles > 637-90-1
637-90-1 | 9-Oxabicyclo[6.1.0]non-4-ene
CAS No: 637-90-1 Catalog No: AG003NLM MDL No:MFCD00086420
Product Description
Catalog Number:
AG003NLM
Chemical Name:
9-Oxabicyclo[6.1.0]non-4-ene
CAS Number:
637-90-1
Molecular Formula:
C8H12O
Molecular Weight:
124.1803
MDL Number:
MFCD00086420
IUPAC Name:
(4Z)-9-oxabicyclo[6.1.0]non-4-ene
InChI:
InChI=1S/C8H12O/c1-2-4-6-8-7(9-8)5-3-1/h1-2,7-8H,3-6H2/b2-1-
InChI Key:
YWFPXWMSGJXUFS-UPHRSURJSA-N
SMILES:
C1=CCCC2C(CC1)O2
EC Number:
211-308-1
NSC Number:
61254
Properties
Complexity:
115
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
124.089g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.183g/mol
Monoisotopic Mass:
124.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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