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Home > Nitro Compounds > 29111-73-7
29111-73-7 | Carbamic acid, N-(4-methyl-2-nitrophenyl)-, methyl ester
CAS No: 29111-73-7 Catalog No: AG002XDG MDL No:
Product Description
Catalog Number:
AG002XDG
Chemical Name:
Carbamic acid, N-(4-methyl-2-nitrophenyl)-, methyl ester
CAS Number:
29111-73-7
Molecular Formula:
C9H10N2O4
Molecular Weight:
210.1867
IUPAC Name:
N-(4-methyl-2-nitrophenyl)acetamide
InChI:
InChI=1S/C9H10N2O3/c1-6-3-4-8(10-7(2)12)9(5-6)11(13)14/h3-5H,1-2H3,(H,10,12)
InChI Key:
LQZGUJSFLJIJKA-UHFFFAOYSA-N
SMILES:
COC(=O)Nc1ccc(cc1[N+](=O)[O-])C
EC Number:
210-312-0
NSC Number:
9826
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.069g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.19g/mol
Monoisotopic Mass:
194.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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