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857753-43-6

857753-43-6 | 1-(4-methyl-3-nitrophenyl)pyrrolidine-2,5-dione

CAS No: 857753-43-6 Catalog No: AG01A9O3 MDL No:MFCD01028285

Product Description

Catalog Number:
AG01A9O3
Chemical Name:
1-(4-methyl-3-nitrophenyl)pyrrolidine-2,5-dione
CAS Number:
857753-43-6
Molecular Formula:
C11H10N2O4
Molecular Weight:
234.2081
MDL Number:
MFCD01028285
IUPAC Name:
1-(4-methyl-3-nitrophenyl)pyrrolidine-2,5-dione
InChI:
InChI=1S/C11H10N2O4/c1-7-2-3-8(6-9(7)13(16)17)12-10(14)4-5-11(12)15/h2-3,6H,4-5H2,1H3
InChI Key:
FTPARFGDHZFCIL-UHFFFAOYSA-N
SMILES:
O=C1CCC(=O)N1c1ccc(c(c1)[N+](=O)[O-])C

Properties

Complexity:
347  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.064g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.211g/mol
Monoisotopic Mass:
234.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  

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