Methyl 3-bromo-1H-1,2,4-triazole-5-carboxylate | CAS No. 704911-47-7

Methyl 3-bromo-1H-1,2,4-triazole-5-carboxylate

Basic Information

CAS Number

704911-47-7

Molecular Formula

C4H4BrN3O2

Molecular Weight

206 g/mol

AD

Basic Physical Properties

COC(=O)C1=NNC(=N1)Br

InChI

InChI=1S/C4H4BrN3O2/c1-10-3(9)2-6-4(5)8-7-2/h1H3,(H,6,7,8)

InChIKey

GRIBRWPXKUMRDX-UHFFFAOYSA-N

LogP

0.3538

Topological Polar Surface Area

67.87 Ų

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

143

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

  • METHYL 5-BROMO-1,2,4-TRIAZOLE-3-CARBOXYLATE
  • Methyl 5-bromo-1H-1 pound not2 pound not4-triazole-3-carboxylate
  • SCHEMBL13941182
  • SCHEMBL23063364
  • SCHEMBL3479027
  • DTXSID00478669
  • methyl 3-bromo-1H-1,2,4-triazole-5-carboxylate
  • AKOS015919874
  • Methyl 5-bromo-4H-1,2,4-triazole-3-carboxylate
  • AM20100665
  • EN300-137427
  • methyl 5-bromo-1H-1,2,4-triazole-3-carboxylate
  • BB 0262036
  • MFCD20230538
  • GS-4146
  • MB13542
  • A866604
  • FT-0683639
  • J-522456
  • AKOS025211685
  • 704911-47-7
  • MFCD13188574
  • 1H-1,2,4-Triazole-3-carboxylic acid, 5-bromo-, methyl ester
  • CS-W019321
  • Methyl 5-bromo-4H-[1,2,4]triazole-3-carboxylate
  • SY022391
  • AKOS005173911
  • Methyl 3-bromo-1H-1,2,4-triazole-5-carboxylate
  • methyl 3-bromo-1H-1,2,4-triazole-5-carboxylate(SALTDATA: FREE)
  • Methyl 5-bromo-1H-1,2,4-triazole-3-carboxylate
  • GRIBRWPXKUMRDX-UHFFFAOYSA-N

MDL Number

MFCD13188574

Customs Code

2933990090

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