Home Aldehydes Benzaldehyde, 4,4'-(1,2-ethynediyl)bis-

Benzaldehyde, 4,4'-(1,2-ethynediyl)bis-

CAS No.:
84907-55-1
Catalog Number:
AG008FS0
Molecular Formula:
C16H10O2
Molecular Weight:
234.2494
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Product Description
Catalog Number:
AG008FS0
Chemical Name:
Benzaldehyde, 4,4'-(1,2-ethynediyl)bis-
CAS Number:
84907-55-1
Molecular Formula:
C16H10O2
Molecular Weight:
234.2494
MDL Number:
MFCD01573051
IUPAC Name:
4-[2-(4-formylphenyl)ethynyl]benzaldehyde
InChI:
InChI=1S/C16H10O2/c17-11-15-7-3-13(4-8-15)1-2-14-5-9-16(12-18)10-6-14/h3-12H
InChI Key:
IZJKYSQCRNPJHX-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)C#Cc1ccc(cc1)C=O
Properties
Complexity:
312  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.068g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.254g/mol
Monoisotopic Mass:
234.068g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties