Hydroxylamine,O-[(4-chlorophenyl)methyl]-, hydrochloride (1:1) supplier

Name
1-[(AMMONIOOXY)METHYL]-4-CHLOROBENZENE CHLORIDE
EINECS
CAS No. 38936-60-6
Article Data11
CAS DataBase
Density
Solubility
Melting Point 230°C
Formula C₇H₉Cl₂NO
Boiling Point 274 °C at 760 mmHg
Molecular Weight 194.061
Flash Point 119.5 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Benzyloxyamine,p-chloro-, hydrochloride (6CI,7CI);Hydroxylamine, O-[(4-chlorophenyl)methyl]-,hydrochloride (9CI);4-Chlorobenzyloxyamine hydrochloride;O-(4-Chlorobenzyl)hydroxylamine hydrochloride;O-(p-Chlorobenzyl)hydroxylaminehydrochloride;
PSA 35.25000
LogP 3.23260

Hydroxylamine,O-[(4-chlorophenyl)methyl]-, hydrochloride (1:1) Specification

The Hydroxylamine,O-[(4-chlorophenyl)methyl]-, hydrochloride (1:1), with CAS registry number 38936-60-6, has the systematic name of 1-[(aminooxy)methyl]-4-chlorobenzene hydrochloride (1:1). And the chemical formula of this chemical is C₇H₉Cl₂NO. Its molecular weight is 194.0585.

Physical properties of Hydroxylamine,O-[(4-chlorophenyl)methyl]-, hydrochloride (1:1): (1)ACD/LogP: 2.14; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 12.47 Å²; (7)Flash Point: 119.5 °C; (8)Enthalpy of Vaporization: 51.24 kJ/mol; (9)Boiling Point: 274 °C at 760 mmHg; (10)Vapour Pressure: 0.00555 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Hydroxylamine,O-[(4-chlorophenyl)methyl]-, hydrochloride (1:1) irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(cc1)CON.Cl
(2)InChI: InChI=1/C7H8ClNO.ClH/c8-7-3-1-6(2-4-7)5-10-9;/h1-4H,5,9H2;1H
(3)InChIKey: VIFDVZZLHVXUHV-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C7H8ClNO.ClH/c8-7-3-1-6(2-4-7)5-10-9;/h1-4H,5,9H2;1H
(5)Std. InChIKey: VIFDVZZLHVXUHV-UHFFFAOYSA-N

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intraperitoneal	650mg/kg (650mg/kg)		Journal of Medicinal Chemistry. Vol. 7, Pg. 329, 1964.

Product Name

1-[(AMMONIOOXY)METHYL]-4-CHLOROBENZENE CHLORIDE

Hydroxylamine,O-[(4-chlorophenyl)methyl]-, hydrochloride (1:1) Specification

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