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84653-89-4 | 1,4-Tetradecadiyne
CAS No: 84653-89-4 Catalog No: AG0050FE MDL No:
Product Description
Catalog Number:
AG0050FE
Chemical Name:
1,4-Tetradecadiyne
CAS Number:
84653-89-4
Molecular Formula:
C14H22
Molecular Weight:
190.3245
IUPAC Name:
tetradeca-1,4-diyne
InChI:
InChI=1S/C14H22/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h1H,4-6,8,10-14H2,2H3
InChI Key:
PPCIOCCVYZZHPK-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC#CCC#C
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.172g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.33g/mol
Monoisotopic Mass:
190.172g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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