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13292-05-2 | 9,10-Phenanthrenedione, 3-bromo-
CAS No: 13292-05-2 Catalog No: AG0011EA MDL No:MFCD18072876
Product Description
Catalog Number:
AG0011EA
Chemical Name:
9,10-Phenanthrenedione, 3-bromo-
CAS Number:
13292-05-2
Molecular Formula:
C14H7BrO2
Molecular Weight:
287.1082
MDL Number:
MFCD18072876
IUPAC Name:
3-bromophenanthrene-9,10-dione
InChI:
InChI=1S/C14H7BrO2/c15-8-5-6-11-12(7-8)9-3-1-2-4-10(9)13(16)14(11)17/h1-7H
InChI Key:
OFVPOKPVPJPQAY-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c1ccccc1C(=O)C2=O
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.963g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.112g/mol
Monoisotopic Mass:
285.963g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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