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Home > Nitro Compounds > 67827-72-9
67827-72-9 | 2-Methoxy-5-nitroaniline hydrochloride
CAS No: 67827-72-9 Catalog No: AG005PMV MDL No:MFCD00060197
Product Description
Catalog Number:
AG005PMV
Chemical Name:
2-Methoxy-5-nitroaniline hydrochloride
CAS Number:
67827-72-9
Molecular Formula:
C7H9ClN2O3
Molecular Weight:
204.6110
MDL Number:
MFCD00060197
IUPAC Name:
2-methoxy-5-nitroaniline;hydrochloride
InChI:
InChI=1S/C7H8N2O3.ClH/c1-12-7-3-2-5(9(10)11)4-6(7)8;/h2-4H,8H2,1H3;1H
InChI Key:
JBBNYKPRONOPHN-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1N)[N+](=O)[O-].Cl
EC Number:
267-234-5
UNII:
4DP906MMG9
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.03g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
204.61g/mol
Monoisotopic Mass:
204.03g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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