1-(1-Naphthyl)ethylamine - CAS 42882-31-5

Name: 1-(1-Naphthyl)ethylamine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB025271
Product Name:	1-(1-Naphthyl)ethylamine
CAS:	42882-31-5
Synonyms:	1-Naphthalenemethanamine, α-methyl-; 1-Naphthalenemethanamine, α-methyl-, (±)-; α-Methyl-1-naphthalenemethanamine; (1-(Naphthalen-1-yl)ethyl)amine; (RS)-1-(1-Naphthyl)ethylamine; (RS)-1-(α-Naphthyl)ethylamine; (±)-1-(1-Naphthyl)ethylamine; (±)-1-(α-Naphthyl)ethylamine; (±)-α-(1-Naphthyl)ethylamine; 1-(Naphthalen-1-yl)ethan-1-amine; 1-(Naphthalen-1-yl)ethanamine; 1-(α-Naphthyl)ethylamine; 1-Amino-1-(1-naphthyl)ethane; 1-Naphthylethylamine; dl-α-(1-Naphthyl)ethylamine; NSC 180601; NSC 75881; α-Methyl-1-naphthalenemethylamine

Technical Data

Related CAS:	3309-13-5 (Deleted CAS)
IUPAC Name:	1-naphthalen-1-ylethanamine
Description:	1-(1-Naphthyl)ethylamine (CAS# 42882-31-5) is used in the enzymic resolution of amines. A chirality modifier.
Molecular Weight:	171.24
Molecular Formula:	C12H13N
Canonical SMILES:	CC(C1=CC=CC2=CC=CC=C21)N
InChI:	InChI=1S/C12H13N/c1-9(13)11-8-4-6-10-5-2-3-7-12(10)11/h2-9H,13H2,1H3
InChI Key:	RTCUCQWIICFPOD-UHFFFAOYSA-N
Boiling Point:	153°C
Purity:	≥95%
Density:	1.063 g/cm³
Appearance:	Colorless to Yellow to Green Clear Liquid
Storage:	Store at RT
MDL:	MFCD00004014
LogP:	3.55980

GHS Hazard Statement:	H301 (67.88%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P260, P261, P264, P270, P271, P273, P280, P301+P310, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P363, P391, P403+P233, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
CN-113122445-A	Equipment for preparing optically pure 1- (1-naphthyl) ethylamine by splitting with immobilized enzyme method and use method	20210506
CN-113341053-A	Analysis method for chiral purity of 1-naphthylethylamine	20210413
CN-113341054-A	Method for measuring excess rate of 1-NEA enantiomer	20210413
CN-113214090-A	Racemization method of 1-naphthylethylamine	20210331
CN-111718228-A	Method for synthesizing carboxylic acid for prolonging two carbon chains by olefin in one step	20200730

PMID	Publication Date	Title	Journal
21726870	20110805	Computational modeling of capillary electrophoretic behavior of primary amines using dual system of 18-crown-6 and β-cyclodextrin	Journal of chromatography. A
19229959	20110701	Enantiopure cyclic O-substituted phenylphosphonothioic acid: synthesis and chirality-recognition ability	Chirality
20205958	20100308	Differential detection of nuclear envelope autoantibodies in primary biliary cirrhosis using routine and alternative methods	BMC gastroenterology
18571802	20090301	Optical resolution of 1-(1-naphthyl)ethylamine by its dicarboxylic acid derivatives: Structural features of the oxalic acid derivative diastereomeric salt pair	Chirality
18855478	20081219	Stereoselective alkylations of chiral nitro imine and nitro hydrazone dianions. Synthesis of enantiomerically enriched 3-substituted 1-nitrocyclohexenes	The Journal of organic chemistry

Complexity:	167
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	171.104799419
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	171.104799419
Rotatable Bond Count:	1
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	2.8