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88184-81-0 | 2H-1-Benzopyran-2-one, 6,8-dibromo-3-nitro-
CAS No: 88184-81-0 Catalog No: AG004CDY MDL No:
Product Description
Catalog Number:
AG004CDY
Chemical Name:
2H-1-Benzopyran-2-one, 6,8-dibromo-3-nitro-
CAS Number:
88184-81-0
Molecular Formula:
C9H3Br2NO4
Molecular Weight:
348.9324
IUPAC Name:
6,8-dibromo-3-nitrochromen-2-one
InChI:
InChI=1S/C9H3Br2NO4/c10-5-1-4-2-7(12(14)15)9(13)16-8(4)6(11)3-5/h1-3H
InChI Key:
JJYDKRNKBRMFGG-UHFFFAOYSA-N
SMILES:
Brc1cc(Br)c2c(c1)cc(c(=O)o2)[N+](=O)[O-]
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.841g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
348.934g/mol
Monoisotopic Mass:
346.843g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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