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249-03-6 | Anthra[2,3-b]benzofuran
CAS No: 249-03-6 Catalog No: AG002PSO MDL No:
Product Description
Catalog Number:
AG002PSO
Chemical Name:
Anthra[2,3-b]benzofuran
CAS Number:
249-03-6
Molecular Formula:
C20H12O
Molecular Weight:
268.3087
IUPAC Name:
10-oxapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(21),2,4,6,8,11,13,15,17,19-decaene
InChI:
InChI=1S/C20H12O/c1-2-6-14-10-16-12-20-18(11-15(16)9-13(14)5-1)17-7-3-4-8-19(17)21-20/h1-12H
InChI Key:
QZICVSAXBDKHAP-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)cc1c(c2)cc2c(c1)c1ccccc1o2
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.089g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.315g/mol
Monoisotopic Mass:
268.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
13.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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