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128231-55-0

Basic Information
CAS No.: 128231-55-0
Name: 4-TERT-BUTYLPHENYLHYDRAZINE HYDROCHLORIDE
Article Data: 4
Molecular Structure:
Molecular Structure of 128231-55-0 (4-TERT-BUTYLPHENYLHYDRAZINE HYDROCHLORIDE)
Formula: C10H17ClN2
Molecular Weight: 200.711
Synonyms: Hydrazine,[4-(1,1-dimethylethyl)phenyl]-, monohydrochloride (9CI);(4-tert-Butylphenyl)hydrazine hydrochloride;(4-tert-Butylphenyl)hydrazinemonohydrochloride;4-(1,1-Dimethylethyl)phenylhydrazine monohydrochloride;
Density: 1.009g/cm3
Melting Point: 212-216 °C (dec.)(lit.)
Boiling Point: 272.4 °C at 760 mmHg
Flash Point: 137.1 °C
Solubility: Soluble in water.
Appearance: white to light yellow crystal powder
Hazard Symbols: HarmfulXn; IrritantXi
Risk Codes: 36/37/38-20/21/22
Safety: 26-36/37/39
PSA: 38.05000
LogP: 3.84500
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Specification

The Hydrazine,[4-(1,1-dimethylethyl)phenyl]-, hydrochloride (1:1), with CAS registry number 128231-55-0, belongs to the following product categories: (1)Aromatic Hydrazides, Hydrazines, Hydrazones and Oximes; (2)Phenylhydrazine. It has the systematic name of (4-tert-butylphenyl)diazanium chloride. This chemical is a kind of white to light yellow crystal powder. And the chemical formula of this chemical is C10H17ClN2.

Physical properties of Hydrazine,[4-(1,1-dimethylethyl)phenyl]-, hydrochloride (1:1): (1)ACD/LogP: 2.94; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.67; (4)ACD/LogD (pH 7.4): 2.93; (5)ACD/BCF (pH 5.5): 54.02; (6)ACD/BCF (pH 7.4): 99.64; (7)ACD/KOC (pH 5.5): 506.81; (8)ACD/KOC (pH 7.4): 934.85; (9)#H bond acceptors: 2; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 3.24 Å2; (13)Flash Point: 137.1 °C; (14)Enthalpy of Vaporization: 51.07 kJ/mol; (15)Boiling Point: 272.4 °C at 760 mmHg; (16)Vapour Pressure: 0.00609 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Hydrazine,[4-(1,1-dimethylethyl)phenyl]-, hydrochloride (1:1) irritates to eyes, respiratory system and skin. And this chemical is harmful by inhalation, in contact with skin and if swallowed. 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: [Cl-].N(c1ccc(cc1)C(C)(C)C)[NH3+]
(2)InChI: InChI=1/C10H16N2.ClH/c1-10(2,3)8-4-6-9(12-11)7-5-8;/h4-7,12H,11H2,1-3H3;1H
(3)InChIKey: VTESCYNPUGSWKG-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C10H16N2.ClH/c1-10(2,3)8-4-6-9(12-11)7-5-8;/h4-7,12H,11H2,1-3H3;1H
(5)Std. InChIKey: VTESCYNPUGSWKG-UHFFFAOYSA-N