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2060-59-5 | 1-Tridecene-3,5,7,9,11-pentayne
CAS No: 2060-59-5 Catalog No: AG002AGX MDL No:
Product Description
Catalog Number:
AG002AGX
Chemical Name:
1-Tridecene-3,5,7,9,11-pentayne
CAS Number:
2060-59-5
Molecular Formula:
C13H6
Molecular Weight:
162.1867
IUPAC Name:
tridec-1-en-3,5,7,9,11-pentayne
InChI:
InChI=1S/C13H6/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3H,1H2,2H3
InChI Key:
KKBHBCOJHHCOCL-UHFFFAOYSA-N
SMILES:
C=CC#CC#CC#CC#CC#CC
UNII:
0W1JQG9623
Properties
Complexity:
518
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.047g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.191g/mol
Monoisotopic Mass:
162.047g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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