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77802-21-2 | [9,9'-Bianthracene]-10-carboxaldehyde
CAS No: 77802-21-2 Catalog No: AG008ODK MDL No:
Product Description
Catalog Number:
AG008ODK
Chemical Name:
[9,9'-Bianthracene]-10-carboxaldehyde
CAS Number:
77802-21-2
Molecular Formula:
C29H18O
Molecular Weight:
382.4526
IUPAC Name:
10-anthracen-9-ylanthracene-9-carbaldehyde
InChI:
InChI=1S/C29H18O/c30-18-27-23-13-5-7-15-25(23)29(26-16-8-6-14-24(26)27)28-21-11-3-1-9-19(21)17-20-10-2-4-12-22(20)28/h1-18H
InChI Key:
BOWPKRAUTREVDO-UHFFFAOYSA-N
SMILES:
O=Cc1c2ccccc2c(c2c1cccc2)c1c2ccccc2cc2c1cccc2
Properties
Complexity:
566
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.136g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
382.462g/mol
Monoisotopic Mass:
382.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8
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