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23674-00-2 | Anthracene, 9-bromo-10-phenoxy-
CAS No: 23674-00-2 Catalog No: AG002O45 MDL No:
Product Description
Catalog Number:
AG002O45
Chemical Name:
Anthracene, 9-bromo-10-phenoxy-
CAS Number:
23674-00-2
Molecular Formula:
C20H13BrO
Molecular Weight:
349.2206
IUPAC Name:
9-bromo-10-phenoxyanthracene
InChI:
InChI=1S/C20H13BrO/c21-19-15-10-4-6-12-17(15)20(18-13-7-5-11-16(18)19)22-14-8-2-1-3-9-14/h1-13H
InChI Key:
RNTVTTWOEKTTRO-UHFFFAOYSA-N
SMILES:
Brc1c2ccccc2c(c2c1cccc2)Oc1ccccc1
Properties
Complexity:
341
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.015g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
349.227g/mol
Monoisotopic Mass:
348.015g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
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