Home Nitros 5-methyl-2-nitro-2,3-dihydro-1H-indene-1,3-dione

5-methyl-2-nitro-2,3-dihydro-1H-indene-1,3-dione

CAS No.:
50919-97-6
Catalog Number:
AG01C3GM
Molecular Formula:
C10H7NO4
Molecular Weight:
205.1669
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Product Description
Catalog Number:
AG01C3GM
Chemical Name:
5-methyl-2-nitro-2,3-dihydro-1H-indene-1,3-dione
CAS Number:
50919-97-6
Molecular Formula:
C10H7NO4
Molecular Weight:
205.1669
MDL Number:
MFCD27924644
IUPAC Name:
5-methyl-2-nitroindene-1,3-dione
InChI:
InChI=1S/C10H7NO4/c1-5-2-3-6-7(4-5)10(13)8(9(6)12)11(14)15/h2-4,8H,1H3
InChI Key:
OCJFPAUIRWLATM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)C1C(=O)c2c(C1=O)ccc(c2)C
Properties
Complexity:
333  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.038g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.169g/mol
Monoisotopic Mass:
205.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties