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Home > Aldehydes > 190441-24-8
190441-24-8 | Benzaldehyde, 4-[2-(9-anthracenyl)ethynyl]-
CAS No: 190441-24-8 Catalog No: AG002EL3 MDL No:
Product Description
Catalog Number:
AG002EL3
Chemical Name:
Benzaldehyde, 4-[2-(9-anthracenyl)ethynyl]-
CAS Number:
190441-24-8
Molecular Formula:
C23H14O
Molecular Weight:
306.3567
IUPAC Name:
4-(2-anthracen-9-ylethynyl)benzaldehyde
InChI:
InChI=1S/C23H14O/c24-16-18-11-9-17(10-12-18)13-14-23-21-7-3-1-5-19(21)15-20-6-2-4-8-22(20)23/h1-12,15-16H
InChI Key:
NWNZNBHYLLXGKM-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)C#Cc1c2ccccc2cc2c1cccc2
Properties
Complexity:
479
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.104g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.364g/mol
Monoisotopic Mass:
306.104g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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