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4187-87-5 | 1-Phenylprop-2-yn-1-ol
CAS No: 4187-87-5 Catalog No: AG003EM1 MDL No:MFCD00021860
Product Description
Catalog Number:
AG003EM1
Chemical Name:
1-Phenylprop-2-yn-1-ol
CAS Number:
4187-87-5
Molecular Formula:
C9H8O
Molecular Weight:
132.1592
MDL Number:
MFCD00021860
IUPAC Name:
1-phenylprop-2-yn-1-ol
InChI:
InChI=1S/C9H8O/c1-2-9(10)8-6-4-3-5-7-8/h1,3-7,9-10H
InChI Key:
UIGLAZDLBZDVBL-UHFFFAOYSA-N
SMILES:
OC(c1ccccc1)C#C
EC Number:
224-064-6
NSC Number:
4326
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.058g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
132.162g/mol
Monoisotopic Mass:
132.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Enantioselective synthesis of the ent-lomaiviticin A bicyclic core. | Organic letters 20121102 |
| Recent improvements in the development of A(2B) adenosine receptor agonists. | Purinergic signalling 20081201 |
| Mono- and dinuclear oxovanadium(V)calixarene complexes and their activity as oxidation catalysts. | Inorganic chemistry 20061002 |
| Antioxidant properties of propargylamine derivatives: assessment of their ability to scavenge peroxynitrite. | The Journal of pharmacy and pharmacology 20060401 |
| 2- and 8-alkynyl-9-ethyladenines: Synthesis and biological activity at human and rat adenosine receptors. | Purinergic signalling 20050601 |
| 2-Phenylhydroxypropynyladenosine derivatives as high potent agonists at A2B adenosine receptor subtype. | Nucleosides, nucleotides & nucleic acids 20030101 |
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