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Home > Nitro Compounds > 159020-78-7
159020-78-7 | Acetamide, N-[2-(1-methylethyl)-6-nitrophenyl]-
CAS No: 159020-78-7 Catalog No: AG001QF1 MDL No:
Product Description
Catalog Number:
AG001QF1
Chemical Name:
Acetamide, N-[2-(1-methylethyl)-6-nitrophenyl]-
CAS Number:
159020-78-7
Molecular Formula:
C11H14N2O3
Molecular Weight:
222.2405
IUPAC Name:
N-(2-nitro-6-propan-2-ylphenyl)acetamide
InChI:
InChI=1S/C11H14N2O3/c1-7(2)9-5-4-6-10(13(15)16)11(9)12-8(3)14/h4-7H,1-3H3,(H,12,14)
InChI Key:
UQGOGZNSJLPTDB-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1c(cccc1[N+](=O)[O-])C(C)C
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.1g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.244g/mol
Monoisotopic Mass:
222.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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