4-Fluoro-2,3-dimethylaniline - CAS 1737-68-4

Catalog:	BB012954
Product Name:	4-Fluoro-2,3-dimethylaniline
CAS:	1737-68-4
Synonyms:	4-fluoro-2,3-dimethylaniline; 4-fluoro-2,3-dimethylaniline

Technical Data

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Computed Properties

IUPAC Name:	4-fluoro-2,3-dimethylaniline
Description:	4-Fluoro-2,3-dimethylaniline (CAS# 1737-68-4) is a useful research chemical.
Molecular Weight:	139.17
Molecular Formula:	C8H10FN
Canonical SMILES:	CC1=C(C=CC(=C1C)F)N
InChI:	InChI=1S/C8H10FN/c1-5-6(2)8(10)4-3-7(5)9/h3-4H,10H2,1-2H3
InChI Key:	LKMJLYCMLAPNDB-UHFFFAOYSA-N
Boiling Point:	231.1 °C at 760 mmHg
Density:	1.083 g/cm³
MDL:	MFCD04972870
LogP:	2.60590

Publication Number	Title	Priority Date
AU-2013307331-A1	Sulfamoyl-arylamides and the use thereof as medicaments for the treatment of Hepatitis B	20120828
AU-2013307337-A1	Sulfamoyl-arylamides and the use thereof as medicaments for the treatment of Hepatitis B	20120828
AU-2013307337-B2	Sulfamoyl-arylamides and the use thereof as medicaments for the treatment of Hepatitis B	20120828
AU-2018204597-A1	Sulfamoyl-arylamides and the use thereof as medicaments for the treatment of Hepatitis B	20120828
AU-2018226485-A1	Sulfamoyl-arylamides and the use thereof as medicaments for the treatment of Hepatitis B	20120828

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GHS Hazard Statement:	H301 (14.29%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	116
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	139.079727485
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	139.079727485
Rotatable Bond Count:	0
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1