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5-(Chloromethyl)-1,2-Dihydro-1,2,4-Triazol-3-One

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5-(Chloromethyl)-1,2-Dihydro-1,2,4-Triazol-3-One / CAS : 252742-72-6

Appearance solid UN 3261
HS 29339900 DG Class 8
Synonyms 3-Chloromethyl-1,2,4-Triazolin-5-One; 5-Chloromethyl-2,4-Dihydro-[1,2,4]Triazol-3-One; 3-(Chloromethyl)-1H-1,2,4-Triazol-5(4H)-one
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Properties

Summary

Formula
C3H4ClN3O
Molecular Mass
133.53600
Exact Mass
133.00400
PSA
61.54000
Logp
-0.16320
IUPAC
3-(chloromethyl)-1,4-dihydro-1,2,4-triazol-5-one
SMILES
C(C1=NNC(=O)N1)Cl

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates

Chemical and Physical Properties

Melting Point
199°C
Density
1.83±0.1 g/cm3
Boiling Point
426°C
Flash Point
35°C
Appearance
solid
Acidity and Basicity
alkalinity

Export information

HS Code
29339900
Export Rebate
13%
UN No.
3261
DG-Class
8

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