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19926-22-8 | Benz[a]anthracene-7,12-dicarboxaldehyde
CAS No: 19926-22-8 Catalog No: AG002C09 MDL No:
Product Description
Catalog Number:
AG002C09
Chemical Name:
Benz[a]anthracene-7,12-dicarboxaldehyde
CAS Number:
19926-22-8
Molecular Formula:
C20H12O2
Molecular Weight:
284.3081
IUPAC Name:
benzo[a]anthracene-7,12-dicarbaldehyde
InChI:
InChI=1S/C20H12O2/c21-11-18-15-7-3-4-8-16(15)19(12-22)20-14-6-2-1-5-13(14)9-10-17(18)20/h1-12H
InChI Key:
VUJRBHIBORKESK-UHFFFAOYSA-N
SMILES:
O=Cc1c2ccc3c(c2c(c2c1cccc2)C=O)cccc3
Properties
Complexity:
431
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.084g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.314g/mol
Monoisotopic Mass:
284.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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