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125096-15-3

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Basic Information
CAS No.: 125096-15-3
Name: 2-(10H-PHENOTHIAZIN-10-YL)ACETOHYDRAZIDE
Article Data: 3
Molecular Structure:
Molecular Structure of 125096-15-3 (2-(10H-PHENOTHIAZIN-10-YL)ACETOHYDRAZIDE)
Formula: C14H13N3OS
Molecular Weight: 271.343
Synonyms: 2-(10H-phenothiazin-10-yl)acetohydrazide;
Density: 1.331 g/cm3
Melting Point: 216 °C
Boiling Point: 526.1 °C at 760 mmHg
Flash Point: 272 °C
PSA: 83.66000
LogP: 3.43540
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Specification

The 10H-Phenothiazine-10-aceticacid, hydrazide, with the CAS registry number 125096-15-3, has the systematic name of 2-(10H-phenothiazin-10-yl)acetohydrazide. It is a kind of organics, and the molecular formula of this chemical is C14H13N3OS.

The physical properties of 10H-Phenothiazine-10-aceticacid, hydrazide are as following: (1)ACD/LogP: 2.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.34; (4)ACD/LogD (pH 7.4): 2.34; (5)ACD/BCF (pH 5.5): 35.17; (6)ACD/BCF (pH 7.4): 35.23; (7)ACD/KOC (pH 5.5): 444.74; (8)ACD/KOC (pH 7.4): 445.55; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 52.09 Å2; (13)Index of Refraction: 1.684; (14)Molar Refractivity: 77.39 cm3; (15)Molar Volume: 203.7 cm3; (16)Polarizability: 30.68×10-24cm3; (17)Surface Tension: 59.6 dyne/cm; (18)Density: 1.331 g/cm3; (19)Flash Point: 272 °C; (20)Enthalpy of Vaporization: 80.03 kJ/mol; (21)Boiling Point: 526.1 °C at 760 mmHg; (22)Vapour Pressure: 3.7E-11 mmHg at 25°C.

Uses of 10H-Phenothiazine-10-aceticacid, hydrazide: It can react with 3-phenyl-propenal to produce phenothiazin-10-yl-acetic acid (3-phenyl-allylidene)-hydrazide. This reaction will need reagent acetic acid, and the solvent ethanol. The reaction time is 5 hours with heating, and the yield is about 57%.
10H-Phenothiazine-10-aceticacid, hydrazide can react with 3-phenyl-propenal to produce phenothiazin-10-yl-acetic acid (3-phenyl-allylidene)-hydrazide

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(NN)CN1c3c(Sc2c1cccc2)cccc3
(2)InChI: InChI=1/C14H13N3OS/c15-16-14(18)9-17-10-5-1-3-7-12(10)19-13-8-4-2-6-11(13)17/h1-8H,9,15H2,(H,16,18)
(3)InChIKey: DGGWSYPHEPMOBE-UHFFFAOYAS