N,N-Dimethylphenylethylamine hydrochloride supplier

Name
N,N-diMethyl-2-phenylethylaMine hydrochloride (USAF EL-79)
EINECS 1592732-453-0
CAS No. 10275-21-5
Article Data2
CAS DataBase
Density g/cm³
Solubility
Melting Point 200-201.5℃
Formula C₁₀H₁₆ClN
Boiling Point 207.3 °C at 760 mmHg
Molecular Weight 185.697
Flash Point 71.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Phenethylamine, N,N-dimethyl-,hydrochloride (8CI);Benzeneethanamine,N,N-dimethyl-, hydrochloride (9CI);AF 2975;N,N-Dimethylphenethylamine hydrochloride;N,N-Dimethyl-2-phenylethanamine hydrochloride (1:1);
PSA 3.24000
LogP 2.59270

Synthetic route

: 67-56-1
methanol

: 83421-80-1
3-phenylpropanoyl azide

: 10275-21-5
N,N-Dimethyl-β-phenethylamine Hydrochloride

Conditions

Conditions	Yield
Stage #1: methanol; 3-phenylpropanoyl azide at 100℃; for 20h; Inert atmosphere; Stage #2: With C54H43ClN3P2Ru(1+)*F6P(1-); potassium carbonate at 140℃; Inert atmosphere;	57%

N,N-Dimethylphenylethylamine hydrochloride Specification

The Benzeneethanamine,N,N-dimethyl-, hydrochloride (1:1), with the CAS registry number 10275-21-5, is also known as N,N-Dimethylphenethylamine hydrochloride. This chemical's molecular formula is C₁₀H₁₆ClN and molecular weight is 185.69. What's more, its systematic name is N,N-dimethyl-2-phenylethanamine hydrochloride (1:1).

Physical properties of Benzeneethanamine,N,N-dimethyl-, hydrochloride (1:1) are: (1)ACD/LogP: 2.14; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.93; (4)ACD/LogD (pH 7.4): -0.14; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1.81; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 3.24 Å²; (13)Flash Point: 71.4 °C; (14)Enthalpy of Vaporization: 44.36 kJ/mol; (15)Boiling Point: 207.3 °C at 760 mmHg; (16)Vapour Pressure: 0.227 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.N(CCc1ccccc1)(C)C
(2)Std. InChI: InChI=1S/C10H15N.ClH/c1-11(2)9-8-10-6-4-3-5-7-10;/h3-7H,8-9H2,1-2H3;1H
(3)Std. InChIKey: OVBRYLBVLSAOAS-UHFFFAOYSA-N

Product Name

N,N-diMethyl-2-phenylethylaMine hydrochloride (USAF EL-79)

Synthetic route

N,N-Dimethylphenylethylamine hydrochloride Specification

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