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Home > Nitro Compounds > 6954-69-4
6954-69-4 | 2,5-DIMETHYL-4-NITRO ACETANILIDE
CAS No: 6954-69-4 Catalog No: AG00FBM0 MDL No:MFCD00547733
Product Description
Catalog Number:
AG00FBM0
Chemical Name:
2,5-DIMETHYL-4-NITRO ACETANILIDE
CAS Number:
6954-69-4
Molecular Formula:
C10H12N2O3
Molecular Weight:
208.2139
MDL Number:
MFCD00547733
IUPAC Name:
N-(2,5-dimethyl-4-nitrophenyl)acetamide
InChI:
InChI=1S/C10H12N2O3/c1-6-5-10(12(14)15)7(2)4-9(6)11-8(3)13/h4-5H,1-3H3,(H,11,13)
InChI Key:
IPRXWEPMOALPTO-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc(C)c(cc1C)[N+](=O)[O-]
NSC Number:
67711
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.085g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.217g/mol
Monoisotopic Mass:
208.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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