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1522-13-0 | 1,1,3-Triphenylpropargyl alcohol
CAS No: 1522-13-0 Catalog No: AG003D6O MDL No:MFCD00004449
Product Description
Catalog Number:
AG003D6O
Chemical Name:
1,1,3-Triphenylpropargyl alcohol
CAS Number:
1522-13-0
Molecular Formula:
C21H16O
Molecular Weight:
284.3511
MDL Number:
MFCD00004449
IUPAC Name:
1,1,3-triphenylprop-2-yn-1-ol
InChI:
InChI=1S/C21H16O/c22-21(19-12-6-2-7-13-19,20-14-8-3-9-15-20)17-16-18-10-4-1-5-11-18/h1-15,22H
InChI Key:
VWRQCJRTHKUVNF-UHFFFAOYSA-N
SMILES:
OC(c1ccccc1)(c1ccccc1)C#Cc1ccccc1
NSC Number:
52241
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.12g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
284.358g/mol
Monoisotopic Mass:
284.12g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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