Benzamide, 4-(1,2,3-thiadiazol-4-yl)- supplier

Name
4-(1,2,3-THIADIAZOL-4-YL)BENZAMIDE
EINECS
CAS No. 175205-53-5
Density 1.374 g/cm³
Solubility
Melting Point
Formula C₉H₇N₃OS
Boiling Point 423.5 °C at 760 mmHg
Molecular Weight 205.24
Flash Point 210 °C
Transport Information
Appearance
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-(1,2,3-THIADIAZOL-4-YL)BENZAMIDE;4-(1,2,3-thiadiazol-4-yl)benzamide, 95+%
PSA 97.11000
LogP 2.00430

Benzamide, 4-(1,2,3-thiadiazol-4-yl)- Specification

This chemical is called Benzamide, 4-(1,2,3-thiadiazol-4-yl)-, and its systematic name is 4-(1,2,3-thiadiazol-4-yl)benzamide. With the molecular formula of C₉H₇N₃OS, its molecular weight is 205.24. The CAS registry number of this chemical is 175205-53-5. Avoid contacting with skin and eyes if you use it.

Other characteristics of the Benzamide, 4-(1,2,3-thiadiazol-4-yl)- can be summarised as followings: (1)ACD/LogP: 1.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.5; (4)ACD/LogD (pH 7.4): 1.5; (5)ACD/BCF (pH 5.5): 8.1; (6)ACD/BCF (pH 7.4): 8.1; (7)ACD/KOC (pH 5.5): 155.58; (8)ACD/KOC (pH 7.4): 155.58; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 74.33 Å²; (13)Index of Refraction: 1.648; (14)Molar Refractivity: 54.34 cm³; (15)Molar Volume: 149.3 cm³; (16)Polarizability: 21.54×10^-24cm³; (17)Surface Tension: 66.5 dyne/cm; (18)Density: 1.374 g/cm³; (19)Flash Point: 210 °C; (20)Enthalpy of Vaporization: 67.79 kJ/mol; (21)Boiling Point: 423.5 °C at 760 mmHg; (22)Vapour Pressure: 2.21E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(c2ccc(c1nnsc1)cc2)N
2.InChI: InChI=1/C9H7N3OS/c10-9(13)7-3-1-6(2-4-7)8-5-14-12-11-8/h1-5H,(H2,10,13)
3.InChIKey: PAVNUEROKSNSDS-UHFFFAOYAD

Product Name

4-(1,2,3-THIADIAZOL-4-YL)BENZAMIDE

Benzamide, 4-(1,2,3-thiadiazol-4-yl)- Specification

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