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Home > Encyclopedia > 1-Methyl-1H-benzotriazole-5-carboxaldehyde

1-Methyl-1H-benzotriazole-5-carboxaldehyde

1-Methyl-1H-benzotriazole-5-carboxaldehyde structure

1-Methyl-1H-benzotriazole-5-carboxaldehyde 

structure
  • CAS No:

    499770-67-1

  • Formula:

    C8H7N3O

  • Chemical Name:

    1-Methyl-1H-benzotriazole-5-carboxaldehyde

  • Synonyms:

    1H-Benzotriazole-5-carboxaldehyde,1-methyl-;1-Methyl-1H-benzotriazole-5-carboxaldehyde;1-Methylbenzotriazole-5-carboxaldehyde;1-Methyl-1H-benzo[d][1,2,3]triazole-5-carboxaldehyde;1-Methyl-1H-1,2,3-benzotriazole-5-carbaldehyde;1-Methyl-1H-benzo[d][1,2,3]triazole-5-carbaldehyde;1-Methylbenzotriazole-5-carbaldehyde

1-Methyl-1H-benzotriazole-5-carboxaldehyde Basic Attributes

161.16100

161.16

DTXSID20383660

2933990090

Characteristics

47.78000

0.78080

1.333g/cm3

159ºC

354.124ºC at 760 mmHg

167.968ºC

1.668

Safety Information

R20/21/22; R36/37/38

S26-S36/37/39

Xn

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:161.16
XLogP3:0.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:161.058911855
Monoisotopic Mass:161.058911855
Topological Polar Surface Area:47.8
Heavy Atom Count:12
Complexity:185
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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