2-methoxy-6-methyl-4-nitroaniline - CAS 665053-99-6

Catalog:	BB033045
Product Name:	2-methoxy-6-methyl-4-nitroaniline
CAS:	665053-99-6
Synonyms:	2-methoxy-6-methyl-4-nitroaniline; 2-methoxy-6-methyl-4-nitroaniline

Technical Data

Patents

Computed Properties

IUPAC Name:	2-methoxy-6-methyl-4-nitroaniline
Description:	2-methoxy-6-methyl-4-nitroaniline (CAS# 665053-99-6 ) is a useful research chemical.
Molecular Weight:	182.18
Molecular Formula:	C8H10N2O3
Canonical SMILES:	CC1=CC(=CC(=C1N)OC)[N+](=O)[O-]
InChI:	InChI=1S/C8H10N2O3/c1-5-3-6(10(11)12)4-7(13-2)8(5)9/h3-4H,9H2,1-2H3
InChI Key:	POWOOYMMFCGHCF-UHFFFAOYSA-N
LogP:	2.59840

Publication Number	Title	Priority Date
EP-1757579-A1	Primary 2,6-disubstituted para-phenylenediamines and their uses for dyeing keratin fibres	20050822
FR-2889846-A1	New paraphenylenediamine compound useful in the dyeing composition for the keratinous fibers, particularly human keratinous fibers e.g. hair	20050822
US-2007044254-A1	Novel 2,6-disubstituted primary para-phenylenediamines and process for their use in the oxidation dyeing of keratin fibers	20050822
JP-2001354633-A	Method for producing 2,5-diaminohydroquinone and / or ether or salt thereof	20000616
GB-2091752-A	Monoazo disperse dyes	19810124

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Complexity:	192
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	182.06914219
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	182.06914219
Rotatable Bond Count:	1
Topological Polar Surface Area:	81.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4