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14703-82-3 | Benzenamine, 3-methoxy-N,N-dimethyl-4-nitro-
CAS No: 14703-82-3 Catalog No: AG001EJN MDL No:MFCD09972264
Product Description
Catalog Number:
AG001EJN
Chemical Name:
Benzenamine, 3-methoxy-N,N-dimethyl-4-nitro-
CAS Number:
14703-82-3
Molecular Formula:
C9H12N2O3
Molecular Weight:
196.2032
MDL Number:
MFCD09972264
IUPAC Name:
3-methoxy-N,N-dimethyl-4-nitroaniline
InChI:
InChI=1S/C9H12N2O3/c1-10(2)7-4-5-8(11(12)13)9(6-7)14-3/h4-6H,1-3H3
InChI Key:
SJPYRQAJLGWUSP-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1[N+](=O)[O-])N(C)C
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.206g/mol
Monoisotopic Mass:
196.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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