4-[4-(Bromomethyl)Phenyl]-1,2,3-Thiadiazole

Base Information

• Chemical Name: 4-[4-(Bromomethyl)Phenyl]-1,2,3-Thiadiazole
• CAS No.: 163798-92-3
• Molecular Formula: C9H7BrN2S
• Molecular Weight: 255.13
• Hs Code.: 2934999090
• European Community (EC) Number: 640-826-4
• DSSTox Substance ID: DTXSID60380092
• Wikidata: Q82170146
• Mol file: 163798-92-3.mol

Synonyms:4-[4-(Bromomethyl)Phenyl]-1,2,3-Thiadiazole;163798-92-3;4-[4-(bromomethyl)phenyl]thiadiazole;4-(4-(Bromomethyl)phenyl)-1,2,3-thiadiazole;4-(1,2,3-Thiadiazol-4-yl)benzyl bromide;1,2,3-Thiadiazole,4-[4-(bromomethyl)phenyl]-;SCHEMBL219769;DTXSID60380092;DGHQOPZIGDRUIT-UHFFFAOYSA-N;MFCD00052102;AKOS015911756;AS-9506;BP-13197;4-(4-bromomethylphenyl)-1,2,3-thiadiazole;FT-0617356;4-(4-Bromomethyl-phenyl)-[1,2,3]thiadiazole;1,2,3-Thiadiazole, 4-[4-(bromomethyl)phenyl]-;W-205929;4-[4-(bromomethyl)phenyl]-1,2,3-thiadiazole, AldrichCPR

Chemical Property of 4-[4-(Bromomethyl)Phenyl]-1,2,3-Thiadiazole

Chemical Property:

• Vapor Pressure: 3.99E-05mmHg at 25°C
• Melting Point: 135 °C
• Refractive Index: 1.645
• Boiling Point: 362.6 °C at 760 mmHg
• PKA: -4.25±0.27(Predicted)
• Flash Point: 173.1 °C
• PSA: 54.02000
• Density: 1.593 g/cm³
• LogP: 3.10000
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 253.95133
• Heavy Atom Count: 13
• Complexity: 160

Purity/Quality:

98%Min ^*data from raw suppliers

4-(1,2,3-Thiadiazol-4-yl)benzylbromide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39-36/39

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1CBr)C2=CSN=N2