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Home > Nitro Compounds > 10073-89-9
10073-89-9 | 2-methyl-6-nitro-4H-3,1-benzoxazin-4-one
CAS No: 10073-89-9 Catalog No: AG00J6SF MDL No:MFCD20039990
Product Description
Catalog Number:
AG00J6SF
Chemical Name:
2-methyl-6-nitro-4H-3,1-benzoxazin-4-one
CAS Number:
10073-89-9
Molecular Formula:
C9H6N2O4
Molecular Weight:
206.1549
MDL Number:
MFCD20039990
IUPAC Name:
2-methyl-6-nitro-3,1-benzoxazin-4-one
InChI:
InChI=1S/C9H6N2O4/c1-5-10-8-3-2-6(11(13)14)4-7(8)9(12)15-5/h2-4H,1H3
InChI Key:
DRISBNJRWVXOEG-UHFFFAOYSA-N
SMILES:
Cc1nc2ccc(cc2c(=O)o1)[N+](=O)[O-]
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.033g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.157g/mol
Monoisotopic Mass:
206.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
84.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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