Basic information
- Name:
Hydrazine,(3,5-difluorophenyl)-, hydrochloride (1:1)
- Superlist Name:
- 3,5-Difluorophenylhydrazine hydrochloride
- CAS No.:
502496-27-7
- Molecular Structure:
- Formula:
- C6H6F2N2.HCl
- Molecular Weight:
- 180.58
- Synonyms:
- Hydrazine,(3,5-difluorophenyl)-, monohydrochloride (9CI);3,5-Difluorophenylhydrazinehydrochloride;
- Melting Point:
- 261-266 °C(lit.)
- Boiling Point:
- 197.9 °C at 760 mmHg
- Flash Point:
- 73.5 °C
- Hazard Symbols:
Xi- Risk Codes:
- 36/37/38
- Safety Description:
- 26-36 Details
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Specification
The Hydrazine,(3,5-difluorophenyl)-, hydrochloride (1:1), with the CAS registry number 502496-27-7, has the systematic name of (3,5-difluorophenyl)diazanium chloride. It belongs to the following product categories: Aromatic Hydrazides, Hydrazines, Hydrazones and Oximes. And the molecular formula of the chemical is C6H6F2N2.HCl.
The characteristics of Hydrazine,(3,5-difluorophenyl)-, hydrochloride (1:1) are as followings: (1)ACD/LogP: 2.26; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.16; (4)ACD/LogD (pH 7.4): 2.26; (5)ACD/BCF (pH 5.5): 24.2; (6)ACD/BCF (pH 7.4): 30.68; (7)ACD/KOC (pH 5.5): 317.97; (8)ACD/KOC (pH 7.4): 403.17; (9)#H bond acceptors: 2; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 3.24 Å2; (13)Flash Point: 73.5 °C; (14)Enthalpy of Vaporization: 43.41 kJ/mol; (15)Boiling Point: 197.9 °C at 760 mmHg; (16)Vapour Pressure: 0.37 mmHg at 25°C.
You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [Cl-].Fc1cc(F)cc(N[NH3+])c1
(2)InChI: InChI=1/C6H6F2N2.ClH/c7-4-1-5(8)3-6(2-4)10-9;/h1-3,10H,9H2;1H
(3)InChIKey: CKCNKYAHVKNKHQ-UHFFFAOYAO