10H-Phenothiazine-10-acetylchloride supplier

Name
PHENOTHIAZINE-10-ACETYL CHLORIDE
EINECS
CAS No. 158502-05-7
Article Data3
CAS DataBase
Density 1.36 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₀ClNOS
Boiling Point 409.5 °C at 760 mmHg
Molecular Weight 275.759
Flash Point 201.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 10H-phenothiazin-10-ylacetyl chloride;
PSA 45.61000
LogP 4.11970

10H-Phenothiazine-10-acetylchloride Specification

The 10H-Phenothiazine-10-acetylchloride, with the CAS registry number 158502-05-7, has the systematic name of 10H-phenothiazin-10-ylacetyl chloride. It belongs to the product category of Pharmacetical, and the molecular formula of this chemical is C₁₄H₁₀ClNOS.

The physical properties of 10H-Phenothiazine-10-acetylchloride are as following: (1)ACD/LogP: 4.43; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.43; (4)ACD/LogD (pH 7.4): 4.43; (5)ACD/BCF (pH 5.5): 1377.64; (6)ACD/BCF (pH 7.4): 1377.64; (7)ACD/KOC (pH 5.5): 6145.97; (8)ACD/KOC (pH 7.4): 6145.97; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 45.61 Å²; (13)Index of Refraction: 1.663; (14)Molar Refractivity: 75.11 cm³; (15)Molar Volume: 202.6 cm³; (16)Polarizability: 29.77×10^-24cm³; (17)Surface Tension: 53.1 dyne/cm; (18)Density: 1.36 g/cm³; (19)Flash Point: 201.5 °C; (20)Enthalpy of Vaporization: 66.17 kJ/mol; (21)Boiling Point: 409.5 °C at 760 mmHg; (22)Vapour Pressure: 6.44E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: ClC(=O)CN1c3c(Sc2c1cccc2)cccc3
(2)InChI: InChI=1/C14H10ClNOS/c15-14(17)9-16-10-5-1-3-7-12(10)18-13-8-4-2-6-11(13)16/h1-8H,9H2
(3)InChIKey: BBGHCAFPASHYSV-UHFFFAOYAC

Product Name

PHENOTHIAZINE-10-ACETYL CHLORIDE

10H-Phenothiazine-10-acetylchloride Specification

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