Home Nitros (4-Amino-2-nitrophenyl)carbamic acid ethyl ester

(4-Amino-2-nitrophenyl)carbamic acid ethyl ester

CAS No.:
73895-87-1
Catalog Number:
AG00F9UI
Molecular Formula:
C9H11N3O4
Molecular Weight:
225.2013
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Product Description
Catalog Number:
AG00F9UI
Chemical Name:
(4-Amino-2-nitrophenyl)carbamic acid ethyl ester
CAS Number:
73895-87-1
Molecular Formula:
C9H11N3O4
Molecular Weight:
225.2013
MDL Number:
MFCD18711762
IUPAC Name:
ethyl N-(4-amino-2-nitrophenyl)carbamate
InChI:
InChI=1S/C9H11N3O4/c1-2-16-9(13)11-7-4-3-6(10)5-8(7)12(14)15/h3-5H,2,10H2,1H3,(H,11,13)
InChI Key:
HDEBGAGNWSBAOY-UHFFFAOYSA-N
SMILES:
CCOC(=O)Nc1ccc(cc1[N+](=O)[O-])N
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.075g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
225.204g/mol
Monoisotopic Mass:
225.075g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties