Benzenemethanamine,3-phenoxy-, hydrochloride (1:1) supplier

Name
3-Phenoxybenzylamine hydrochloride
EINECS
CAS No. 376637-85-3
Article Data2
CAS DataBase
Density 1.106g/cm³
Solubility
Melting Point 185.5 °C
Formula C₁₃H₁₄ClNO
Boiling Point 354.4 °C at 760 mmHg
Molecular Weight 235.713
Flash Point 168.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzenemethanamine,3-phenoxy-, hydrochloride (9CI);3-Phenoxybenzylamine hydrochloride;
PSA 35.25000
LogP 4.43990

Benzenemethanamine,3-phenoxy-, hydrochloride (1:1) Specification

The Benzenemethanamine,3-phenoxy-, hydrochloride (1:1), with the CAS registry number 376637-85-3, is also known as 3-Phenoxybenzylamine hydrochloride. This chemical's molecular formula is C₁₃H₁₄ClNO and molecular weight is 235.71. What's more, its systematic name is 1-(3-phenoxyphenyl)methanamine hydrochloride (1:1).

Physical properties of Benzenemethanamine,3-phenoxy-, hydrochloride (1:1) are: (1)ACD/LogP: 3.08; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 2; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 17; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 35.25 Å²; (13)Flash Point: 168.1 °C; (14)Enthalpy of Vaporization: 61.13 kJ/mol; (15)Boiling Point: 354.4 °C at 760 mmHg; (16)Vapour Pressure: 2.35E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: Cl.NCc2cc(Oc1ccccc1)ccc2
(2)InChI: InChI=1/C13H13NO.ClH/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12;/h1-9H,10,14H2;1H
(3)InChIKey: WMFHUUKYIUOHRA-UHFFFAOYAH

Product Name

3-Phenoxybenzylamine hydrochloride

Benzenemethanamine,3-phenoxy-, hydrochloride (1:1) Specification

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