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25001-92-7 | 3,5-Octadiene
CAS No: 25001-92-7 Catalog No: AG002Q63 MDL No:
Product Description
Catalog Number:
AG002Q63
Chemical Name:
3,5-Octadiene
CAS Number:
25001-92-7
Molecular Formula:
C8H14
Molecular Weight:
110.1968
IUPAC Name:
octa-3,5-diene
InChI:
InChI=1S/C8H14/c1-3-5-7-8-6-4-2/h5-8H,3-4H2,1-2H3
InChI Key:
HWXQYUCHSICMAS-UHFFFAOYSA-N
SMILES:
CCC=CC=CCC
Properties
Complexity:
66
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
110.11g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
110.2g/mol
Monoisotopic Mass:
110.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
3.2
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