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82071-23-6 | 5H-Benzo[a]phenoxazin-5-one, 6-bromo-10-methyl-
CAS No: 82071-23-6 Catalog No: AG005CEW MDL No:
Product Description
Catalog Number:
AG005CEW
Chemical Name:
5H-Benzo[a]phenoxazin-5-one, 6-bromo-10-methyl-
CAS Number:
82071-23-6
Molecular Formula:
C17H10BrNO2
Molecular Weight:
340.1708
IUPAC Name:
6-bromo-10-methylbenzo[a]phenoxazin-5-one
InChI:
InChI=1S/C17H10BrNO2/c1-9-6-7-13-12(8-9)19-15-10-4-2-3-5-11(10)16(20)14(18)17(15)21-13/h2-8H,1H3
InChI Key:
HYOZVSKTUAAXRD-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)nc1c(o2)c(Br)c(=O)c2c1cccc2
Properties
Complexity:
539
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.989g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
340.176g/mol
Monoisotopic Mass:
338.989g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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