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1129-65-3 | 1-PHENYL-1-HEXYNE
CAS No: 1129-65-3 Catalog No: AG003ELQ MDL No:MFCD00039969
Product Description
Catalog Number:
AG003ELQ
Chemical Name:
1-PHENYL-1-HEXYNE
CAS Number:
1129-65-3
MDL Number:
MFCD00039969
IUPAC Name:
hex-1-ynylbenzene
InChI:
InChI=1S/C12H14/c1-2-3-4-6-9-12-10-7-5-8-11-12/h5,7-8,10-11H,2-4H2,1H3
InChI Key:
VBRLZTLFLNZEPZ-UHFFFAOYSA-N
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.11g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.244g/mol
Monoisotopic Mass:
158.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
Literature
| Title | Journal |
|---|---|
| Antinociceptive effect of butyl (2-phenylethynyl) selenide on formalin test in mice: Evidences for the involvement of serotonergic and adenosinergic systems. | European journal of pharmacology 20101010 |
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