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1785-53-1 | 2,9-Undecadiyne
CAS No: 1785-53-1 Catalog No: AG002648 MDL No:
Product Description
Catalog Number:
AG002648
Chemical Name:
2,9-Undecadiyne
CAS Number:
1785-53-1
Molecular Formula:
C11H16
Molecular Weight:
148.2447
IUPAC Name:
undeca-2,9-diyne
InChI:
InChI=1S/C11H16/c1-3-5-7-9-11-10-8-6-4-2/h7-11H2,1-2H3
InChI Key:
FKKNTXVGHXTKPZ-UHFFFAOYSA-N
SMILES:
CC#CCCCCCC#CC
Properties
Complexity:
173
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:
4
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