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1073-07-0 | 1,4-Cyclooctadiene
CAS No: 1073-07-0 Catalog No: AG001TZ7 MDL No:
Product Description
Catalog Number:
AG001TZ7
Chemical Name:
1,4-Cyclooctadiene
CAS Number:
1073-07-0
Molecular Formula:
C8H12
Molecular Weight:
108.1809
IUPAC Name:
(1Z,4Z)-cycloocta-1,4-diene
InChI:
InChI=1S/C8H12/c1-2-4-6-8-7-5-3-1/h1-2,5,7H,3-4,6,8H2/b2-1-,7-5-
InChI Key:
DNZZPKYSGRTNGK-PQZOIKATSA-N
SMILES:
C1CC=CCC=CC1
Properties
Complexity:
86.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Exact Mass:
108.094g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
108.184g/mol
Monoisotopic Mass:
108.094g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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