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57341-98-7 | 4-(Phenylethynyl)benzaldehyde
CAS No: 57341-98-7 Catalog No: AG003KA0 MDL No:MFCD00114585
Product Description
Catalog Number:
AG003KA0
Chemical Name:
4-(Phenylethynyl)benzaldehyde
CAS Number:
57341-98-7
Molecular Formula:
C15H10O
Molecular Weight:
206.2393
MDL Number:
MFCD00114585
IUPAC Name:
4-(2-phenylethynyl)benzaldehyde
InChI:
InChI=1S/C15H10O/c16-12-15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-5,8-12H
InChI Key:
SYCFYQFCFHKYPI-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)C#Cc1ccccc1
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.073g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.244g/mol
Monoisotopic Mass:
206.073g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
Literature
| Title | Journal |
|---|---|
| Conformationally constrained analogues of diacylglycerol (DAG). 31. Modulation of the biological properties of diacylgycerol lactones (DAG-lactones) containing rigid-rod acyl groups separated from the core lactone by spacer units of different lengths. | Journal of medicinal chemistry 20090528 |
| Self-assembly and lipid interactions of diacylglycerol lactone derivatives studied at the air/water interface. | Langmuir : the ACS journal of surfaces and colloids 20081007 |
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