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10160-98-2 | 1,5-Undecadiyne
CAS No: 10160-98-2 Catalog No: AG0004Z1 MDL No:
Product Description
Catalog Number:
AG0004Z1
Chemical Name:
1,5-Undecadiyne
CAS Number:
10160-98-2
Molecular Formula:
C11H16
Molecular Weight:
148.2447
IUPAC Name:
undeca-1,5-diyne
InChI:
InChI=1S/C11H16/c1-3-5-7-9-11-10-8-6-4-2/h1H,4-8,10H2,2H3
InChI Key:
CKKFRXDKWZPFTD-UHFFFAOYSA-N
SMILES:
CCCCCC#CCCC#C
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.125g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.249g/mol
Monoisotopic Mass:
148.125g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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