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Home > Nitro Compounds > 13142-90-0
13142-90-0 | (2-methoxy-5-nitrophenyl)urea
CAS No: 13142-90-0 Catalog No: AG01BFAY MDL No:MFCD28118549
Product Description
Catalog Number:
AG01BFAY
Chemical Name:
(2-methoxy-5-nitrophenyl)urea
CAS Number:
13142-90-0
Molecular Formula:
C8H9N3O4
Molecular Weight:
211.1748
MDL Number:
MFCD28118549
IUPAC Name:
(2-methoxy-5-nitrophenyl)urea
InChI:
InChI=1S/C8H9N3O4/c1-15-7-3-2-5(11(13)14)4-6(7)10-8(9)12/h2-4H,1H3,(H3,9,10,12)
InChI Key:
UUFYJAGPRWSOOL-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1NC(=O)N)[N+](=O)[O-]
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.059g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
211.177g/mol
Monoisotopic Mass:
211.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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