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129066-17-7 | 1,3,5,7-Nonatetrayne
CAS No: 129066-17-7 Catalog No: AG000YTF MDL No:
Product Description
Catalog Number:
AG000YTF
Chemical Name:
1,3,5,7-Nonatetrayne
CAS Number:
129066-17-7
Molecular Formula:
C9H4
Molecular Weight:
112.1281
IUPAC Name:
nona-1,3,5,7-tetrayne
InChI:
InChI=1S/C9H4/c1-3-5-7-9-8-6-4-2/h1H,2H3
InChI Key:
WZZXZKDJDUNZAG-UHFFFAOYSA-N
SMILES:
CC#CC#CC#CC#C
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.031g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
112.131g/mol
Monoisotopic Mass:
112.031g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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