Product Name

  • Name

    1-[(AMMONIOOXY)METHYL]-3-CHLOROBENZENE CHLORIDE

  • EINECS
  • CAS No. 29605-78-5
  • Article Data11
  • CAS DataBase
  • Density
  • Solubility
  • Melting Point 206-212 °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 Molecular Structure of 29605-78-5 (1-[(AMMONIOOXY)METHYL]-3-CHLOROBENZENE CHLORIDE)
  • Hazard Symbols IrritantXi
  • Synonyms Hydroxylamine,O-(m-chlorobenzyl)-, hydrochloride (8CI);Hydroxylamine, O-[(3-chlorophenyl)methyl]-,hydrochloride (9CI);m-Chlorobenzyloxyamine hydrochloride;
  • PSA 35.25000
  • LogP 3.23260

Hydroxylamine,O-[(3-chlorophenyl)methyl]-, hydrochloride (1:1) Specification

The Hydroxylamine,O-[(3-chlorophenyl)methyl]-, hydrochloride (1:1), with the CAS registry number 29605-78-5, is also known as O-(m-Chlorobenzyl)hydroxylamine hydrochloride. This chemical's molecular formula is C7H9Cl2NO and molecular weight is 194.05846. Its IUPAC name is called O-[(3-chlorophenyl)methyl]hydroxylamine hydrochloride. This chemical's classification code is Drug / Therapeutic Agent.

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

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=CC(=C1)Cl)CON.Cl
(2)InChI: InChI=1S/C7H8ClNO.ClH/c8-7-3-1-2-6(4-7)5-10-9;/h1-4H,5,9H2;1H
(3)InChIKey: PZPCEIVCWGWHCC-UHFFFAOYSA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 275mg/kg (275mg/kg)   Journal of Pharmaceutical Sciences. Vol. 59, Pg. 1752, 1970.

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