5-chloro-2-(2-phenylethynyl)benzaldehyde

5-chloro-2-(2-phenylethynyl)benzaldehyde

CAS: 1186603-47-3

Formula: C15H9ClO

SMILES: ClC1=CC=C(C#CC2=CC=CC=C2)C(C=O)=C1

IUPAC: 5-chloro-2-(2-phenylethynyl)benzaldehyde

InChI: InChI=1S/C15H9ClO/c16-15-9-8-13(14(10-15)11-17)7-6-12-4-2-1-3-5-12/h1-5,8-11H

Composition: C (74.85%), H (3.77%), Cl (14.73%), O (6.65%)

Molar Mass: 240.69

Atom Count: 26

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	240.0341926
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	HXSGNDDPFCKTOS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.28
Topological Polar Surface Area	17.07
Polarizability	26.24
Ring Count	2
Rotatable Bond Count	3

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97%	<5 Days	1186603-47-3		$39.09-$59.27$39.09$59.27