1-(3-Chloropropionyl)-1H-benzotriazole

Base Information

• Chemical Name: 1-(3-Chloropropionyl)-1H-benzotriazole
• CAS No.: 304660-39-7
• Molecular Formula: C9H8 Cl N3 O
• Molecular Weight: 209.63
• European Community (EC) Number: 687-475-3
• DSSTox Substance ID: DTXSID80396216
• Wikidata: Q82196810
• Mol file: 304660-39-7.mol

Synonyms:1-(3-Chloropropionyl)-1H-benzotriazole;304660-39-7;1-(benzotriazol-1-yl)-3-chloropropan-1-one;1-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-chloropropan-1-one;SCHEMBL2489579;DTXSID80396216;1-(3-Chloropropionyl)-1H-benzotriazole, 97%;1-(2-CHLOROACETHYLCARBONYL)-1H-BENZOTRI&;1-(1H-1,2,3-benzotriazol-1-yl)-3-chloropropan-1-one

Chemical Property of 1-(3-Chloropropionyl)-1H-benzotriazole

Chemical Property:

• Vapor Pressure: 2.35E-05mmHg at 25°C
• Melting Point: 76-80 °C(lit.)
• Refractive Index: 1.661
• Boiling Point: 359.6°C at 760 mmHg
• Flash Point: 171.3°C
• PSA: 47.78000
• Density: 1.42g/cm³
• LogP: 1.70040
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 209.0355896
• Heavy Atom Count: 14
• Complexity: 224

Purity/Quality:

98%Min ^*data from raw suppliers

1-(3-Chloropropionyl)-1H-benzotriazole 97% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N=NN2C(=O)CCCl