1-Amino-1-phenylacetone hydrochloride supplier

Name
1-Amino-1-phenylacetone hydrochloride
EINECS
CAS No. 3904-16-3
Article Data6
CAS DataBase
Density
Solubility
Melting Point
Formula C₉H₁₁NO^.HCl
Boiling Point 235.2 °C at 760 mmHg
Molecular Weight 185.653
Flash Point 96.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Propanone,1-amino-1-phenyl-, hydrochloride (6CI,7CI,8CI,9CI);1-Amino-1-phenyl-2-propanone hydrochloride;1-Amino-1-phenylacetonehydrochloride;
PSA 43.09000
LogP 2.77770

1-Amino-1-phenylacetone hydrochloride Specification

The 1-Amino-1-phenylacetone hydrochloride with the cas number 3904-16-3 is also called 2-Propanone,1-amino-1-phenyl-,hydrochloride (1:1). The systematic name is 1-amino-1-phenylpropan-2-one hydrochloride. Its molecular formula is C₉H₁₁NO^.HCl. The product's Category is Phenyls & Phenyl-Het.

The properties of the chemical are: (1)ACD/LogP: 0.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.29; (4)ACD/LogD (pH 7.4): 0.81; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 2.32; (7)ACD/KOC (pH 5.5): 4.87; (8)ACD/KOC (pH 7.4): 60.79; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 20.31 Å²; (13)Enthalpy of Vaporization: 47.2 kJ/mol; (14)Vapour Pressure: 0.0506 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O=C(C(N)c1ccccc1)C
(2)InChI: InChI=1/C9H11NO.ClH/c1-7(11)9(10)8-5-3-2-4-6-8;/h2-6,9H,10H2,1H3;1H
(3)InChIKey: PLWANCOYVAFWCA-UHFFFAOYAU

Product Name

1-Amino-1-phenylacetone hydrochloride

1-Amino-1-phenylacetone hydrochloride Specification

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