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2-NONYNE

CAS No.:
19447-29-1
Catalog Number:
AG003HTF
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG003HTF
Chemical Name:
2-NONYNE
CAS Number:
19447-29-1
MDL Number:
MFCD00039986
IUPAC Name:
non-2-yne
InChI:
InChI=1S/C9H16/c1-3-5-7-9-8-6-4-2/h3,5,7-9H2,1-2H3
InChI Key:
LXKRETAGISZJAD-UHFFFAOYSA-N
Properties
Complexity:
99.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.125g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.227g/mol
Monoisotopic Mass:
124.125g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Literature
Title Journal
Identification of 2-nonynoic acid, a cosmetic component, as a potential trigger of primary biliary cirrhosis. Journal of autoimmunity 20060801
Properties