[2-Amino-1-(2-fluorophenyl)ethyl]dimethylamine - CAS 842954-76-1

Catalog:	BB074810
Product Name:	[2-Amino-1-(2-fluorophenyl)ethyl]dimethylamine
CAS:	842954-76-1
Synonyms:	[2-amino-1-(2-fluorophenyl)ethyl]dimethylamine; 1-(2-fluorophenyl)-N,N-dimethylethane-1,2-diamine; 1-(2-Fluoro-phenyl)-N1,N1-dimethyl-ethane-1,2-diamine; 1-(2-Fluorophenyl)-N1,N1-dimethylethane-1,2-diamine; 1-(2-Fluoro-phenyl)-N1,N1-dimethyl-ethane-1,2-diamine

Technical Data

Computed Properties

IUPAC Name:	1-(2-fluorophenyl)-N,N-dimethylethane-1,2-diamine
Description:	[2-Amino-1-(2-fluorophenyl)ethyl]dimethylamine
Molecular Weight:	182.24
Molecular Formula:	C10H15FN2
Canonical SMILES:	CN(C)C(CN)C1=CC=CC=C1F
InChI:	InChI=1S/C10H15FN2/c1-13(2)10(7-12)8-5-3-4-6-9(8)11/h3-6,10H,7,12H2,1-2H3
InChI Key:	SHXWXJULVODFTN-UHFFFAOYSA-N

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Complexity:	150
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	182.12192665
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	182.12192665
Rotatable Bond Count:	3
Topological Polar Surface Area:	29.3Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1