(1-methyl-1H-benzo[d][1,2,3]triazol-5-yl)methanol

Base Information

• Chemical Name: (1-methyl-1H-benzo[d][1,2,3]triazol-5-yl)methanol
• CAS No.: 120321-72-4
• Molecular Formula: C8H9N3O
• Molecular Weight: 163.18
• Hs Code.: 2933990090
• European Community (EC) Number: 820-369-9
• DSSTox Substance ID: DTXSID20380179
• Wikidata: Q72488019
• Mol file: 120321-72-4.mol

Synonyms:120321-72-4;(1-methyl-1H-benzo[d][1,2,3]triazol-5-yl)methanol;(1-Methyl-1H-1,2,3-Benzotriazol-5-Yl)Methanol;(1-methylbenzotriazol-5-yl)methanol;1-Methyl-1H-benzotriazole-5-methanol;(1-methyl-5-benzotriazolyl)methanol;RYD;1H-Benzotriazole-5-methanol, 1-methyl-;SCHEMBL1939333;DTXSID20380179;HVLCKOBNGNRDPT-UHFFFAOYSA-N;MFCD00962482;AKOS006228041;AC-4627;DS-1484;PS-4303;SDCCGMLS-0066043.P001;(1-Methyl-1H-benzotriazol-5-yl)methanol;FT-0604515;EN300-82608;(1-methyl-1H-1,2,3-benzotriazole-5-yl)methanol;A804487;A804488;W-205090;Z1201620716;(1-methyl-1H-1,2,3-benzotriazol-5-yl)methanol, AldrichCPR

Chemical Property of (1-methyl-1H-benzo[d][1,2,3]triazol-5-yl)methanol

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 94 °C
• Refractive Index: 1.668
• Boiling Point: 375.09 °C at 760 mmHg
• PKA: 13.85±0.10(Predicted)
• Flash Point: 180.648 °C
• PSA: 50.94000
• Density: 1.35g/cm³
• LogP: 0.46060
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 163.074561919
• Heavy Atom Count: 12
• Complexity: 164

Purity/Quality:

99% ^*data from raw suppliers

(1-Methyl-1H-1,2,3-benzotriazol-5-yl)methanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38-41
• Safety Statements: 26-36/37/39-24/25-39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2=C(C=C(C=C2)CO)N=N1
• Uses: (1-Methyl-1H-1,2,3-benzotriazol-5-yl)methanol is a building block used in the preparation of pyrimidine derivatives as histone deacetylase inhibitors.