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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

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Diss Factsheets

Reference substances

Reference substances

Currently viewing:
IUPAC name:
5-methyl-1H-1,2,3-benzotriazole

Inventory

EC number:
249-596-6
EC name:
Methyl-1H-benzotriazole
CAS number:
29385-43-1
CAS number:
29385-43-1
Synonyms
Names:
1H-Benzotriazole, 4(or 5)-methyl-
Identifier:
CAS number
29385-43-1
Identifier:
IUPAC name
1-methyl-1H-benzotriazole
Identifier:
IUPAC name
4(or5)-methyl-1H-benzotriazole
Identifier:
IUPAC name
5-methyl-1H-1,2,3-benzotriazole
Identifier:
IUPAC name
5-methyl-1H-1,2,3-benzotriazole
Identifier:
IUPAC name
Methyl-1H-benzotriazole
Identifier:
IUPAC name
Reaction mass of 4-methyl-1H-benzotriazole and 5-methyl-1H-benzotriazole
Identifier:
other: InChl
InChI=1S/C7H7N3/c1-5-2-3-6-7(4-5)9-10-8-6/h2-4H,1H3,(H,8,9,10) InChI=1S/C7H7N3/c1-5-3-2-4-6-7(5)9-10-8-6/h2-4H,1H3,(H,8,9,10)
Identifier:
other: SMILES notation
Cn1nnc2ccccc12
Identifier:
other: InChl
InChI=1/C7H7N3/c1-10-7-5-3-2-4-6(7)8-9-10/h2-5H,1H3
Identifier:
other: SMILES notation
c1cc2c(cc1)[nH]nn2.[*]C
4(or5)-methyl-1H-1,2,3-benzotriazole

Molecular and structural information

Molecular formula:
C7H7N3
Molecular weight:
133.151
SMILES notation:
cc1ccc2nnnc2c1
cc1ccc2nnnc12
InChl:
InChI=1S/C7H7N3/c1-5-2-3-6-7(4-5)9-10-8-6/h2-4H,1H3,(H,8,9,10)
InChI=1S/C7H7N3/c1-5-3-2-4-6-7(5)9-10-8-6/h2-4H,1H3,(H,8,9,10)
Structural formula:
Chemical structure

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