Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

1,2,4-Thiadiazol-5-amine,3-phenyl-

Related Products

Hot Products

Name

1,2,4-Thiadiazol-5-amine,3-phenyl-

EINECS 241-485-0
CAS No. 17467-15-1 Density 1.333 g/cm3
PSA 80.04000 LogP 2.36850
Solubility N/A Melting Point 152-156 °C
Formula C8H7N3S Boiling Point 359 °C at 760 mmHg
Molecular Weight 177.23 Flash Point 170.9 °C
Transport Information N/A Appearance light brownish fine crystalline powder
Safety 36/37/39-26-22 Risk Codes 36/37/38-20/21/22
Molecular Structure Molecular Structure of 17467-15-1 (5-AMINO-3-PHENYL-1,2,4-THIADIAZOLE) Hazard Symbols HarmfulXn; IrritantXi
Synonyms

1,2,4-Thiadiazole,5-amino-3-phenyl- (6CI,8CI);(3-Phenyl-[1,2,4]thiadiazol-5-yl)amine;3-Phenyl-1,2,4-thiadiazol-5-amine;5-Amino-3-phenyl-1,2,4-thiadiazole;NSC119930;

Article Data 11

1,2,4-Thiadiazol-5-amine,3-phenyl- Specification

The 1,2,4-Thiadiazol-5-amine,3-phenyl-, with the CAS registry number 17467-15-1 and EINECS registry number 241-485-0, has the systematic name and IUPAC name of 3-phenyl-1,2,4-thiadiazol-5-amine. It is a kind of light brownish fine crystalline powder, and the molecular formula of the chemical is C8H7N3S.

The characteristics of 1,2,4-Thiadiazol-5-amine,3-phenyl- are as followings: (1)ACD/LogP: 2.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.03; (4)ACD/LogD (pH 7.4): 2.03; (5)ACD/BCF (pH 5.5): 20.48; (6)ACD/BCF (pH 7.4): 20.52; (7)ACD/KOC (pH 5.5): 302.03; (8)ACD/KOC (pH 7.4): 302.62; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 57.26 Å2; (13)Index of Refraction: 1.669; (14)Molar Refractivity: 49.64 cm3; (15)Molar Volume: 132.9 cm3; (16)Polarizability: 19.68×10-24cm3; (17)Surface Tension: 65.3 dyne/cm; (18)Density: 1.333 g/cm3; (19)Flash Point: 170.9 °C; (20)Enthalpy of Vaporization: 60.46 kJ/mol; (21)Boiling Point: 359 °C at 760 mmHg; (22)Vapour Pressure: 2.45E-05 mmHg at 25°C. 

Uses of 1,2,4-Thiadiazol-5-amine,3-phenyl-: It can react with methoxyacetyl chloride to produce 2-methoxy-N-(3-phenyl-[1,2,4]thiadiazol-5-yl)-acetamide. This reaction will need reagent pyridine. The reaction time is 3 hours, and the yield is about 58%.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin, and it is also harmful by inhalation, in contact with skin and if swallowed. Therefore, you had better take the following instructions: Do not breathe dust; Wear suitable protective clothing, gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice. 

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: n1c(snc1c2ccccc2)N
(2)InChI: InChI=1/C8H7N3S/c9-8-10-7(11-12-8)6-4-2-1-3-5-6/h1-5H,(H2,9,10,11)
(3)InChIKey: OYAHSBDYBOBAAQ-UHFFFAOYAQ

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
bird - wild LD50 oral 56200ug/kg (56.2mg/kg)   Archives of Environmental Contamination and Toxicology. Vol. 12, Pg. 355, 1983.
quail LD50 oral 75mg/kg (75mg/kg)   Ecotoxicology and Environmental Safety. Vol. 6, Pg. 149, 1982.

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 17467-15-1