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Home > Aldehydes > 652976-99-3
652976-99-3 | 1,3-Benzenedicarboxaldehyde, 2-(2-naphthalenyl)-
CAS No: 652976-99-3 Catalog No: AG006TME MDL No:
Product Description
Catalog Number:
AG006TME
Chemical Name:
1,3-Benzenedicarboxaldehyde, 2-(2-naphthalenyl)-
CAS Number:
652976-99-3
Molecular Formula:
C18H12O2
Molecular Weight:
260.2867
IUPAC Name:
2-naphthalen-2-ylbenzene-1,3-dicarbaldehyde
InChI:
InChI=1S/C18H12O2/c19-11-16-6-3-7-17(12-20)18(16)15-9-8-13-4-1-2-5-14(13)10-15/h1-12H
InChI Key:
XFXKPCMWGXIIMQ-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1c1ccc2c(c1)cccc2)C=O
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.084g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.292g/mol
Monoisotopic Mass:
260.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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