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72525-07-6 | 1,7-Octadiyne, 4,5-bis(methylene)-
CAS No: 72525-07-6 Catalog No: AG005GFJ MDL No:
Product Description
Catalog Number:
AG005GFJ
Chemical Name:
1,7-Octadiyne, 4,5-bis(methylene)-
CAS Number:
72525-07-6
Molecular Formula:
C10H10
Molecular Weight:
130.1864
IUPAC Name:
4,5-dimethylideneocta-1,7-diyne
InChI:
InChI=1S/C10H10/c1-5-7-9(3)10(4)8-6-2/h1-2H,3-4,7-8H2
InChI Key:
OGHJRSVEGPOZNV-UHFFFAOYSA-N
SMILES:
C#CCC(=C)C(=C)CC#C
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.078g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
130.19g/mol
Monoisotopic Mass:
130.078g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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