10H-Phenothiazine, 4-chloro- supplier

Name
4-CHLOROPHENOTHIAZINE
EINECS
CAS No. 7369-69-9
Article Data4
CAS DataBase
Density 1.346 g/cm³
Solubility
Melting Point 116-117 °C
Formula C₁₂H₈ClNS
Boiling Point 382.6 °C at 760 mmHg
Molecular Weight 233.721
Flash Point 185.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Chloro-10H-phenothiazine;4-Chlorophenothiazine;
PSA 37.33000
LogP 4.68620

10H-Phenothiazine, 4-chloro- Specification

The 10H-Phenothiazine, 4-chloro-, with the CAS registry number 7369-69-9, is also known as 4-Chlorophenothiazine. This chemical's molecular formula is C₁₂H₈ClNS and molecular weight is 233.72. What's more, its IUPAC name is 4-chloro-10H-phenothiazine.

Physical properties of 10H-Phenothiazine, 4-chloro- are: (1)ACD/LogP: 4.75; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.75; (4)ACD/LogD (pH 7.4): 4.75; (5)ACD/BCF (pH 5.5): 2378.22; (6)ACD/BCF (pH 7.4): 2378.22; (7)ACD/KOC (pH 5.5): 9084.83; (8)ACD/KOC (pH 7.4): 9084.83; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 28.54 Å²; (13)Index of Refraction: 1.68; (14)Molar Refractivity: 65.58 cm³; (15)Molar Volume: 173.5 cm³; (16)Polarizability: 26×10^-24cm³; (17)Surface Tension: 54.2 dyne/cm; (18)Density: 1.346 g/cm³; (19)Flash Point: 185.2 °C; (20)Enthalpy of Vaporization: 63.1 kJ/mol; (21)Boiling Point: 382.6 °C at 760 mmHg; (22)Vapour Pressure: 4.68E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C2C(=C1)NC3=C(S2)C(=CC=C3)Cl
(2)InChI: InChI=1S/C12H8ClNS/c13-8-4-3-6-10-12(8)15-11-7-2-1-5-9(11)14-10/h1-7,14H
(3)InChIKey: NZOYBWLCZWTECI-UHFFFAOYSA-N

Product Name

4-CHLOROPHENOTHIAZINE

10H-Phenothiazine, 4-chloro- Specification

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