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438022

Sigma-Aldrich

1-(Methoxymethyl)-1H-benzotriazole

99%

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About This Item

Empirical Formula (Hill Notation):
C8H9N3O
CAS Number:
Molecular Weight:
163.18
MDL number:
UNSPSC Code:
12352005
PubChem Substance ID:
NACRES:
NA.22

Assay

99%

form

solid

mp

42-43 °C (lit.)

SMILES string

COCn1nnc2ccccc12

InChI

1S/C8H9N3O/c1-12-6-11-8-5-3-2-4-7(8)9-10-11/h2-5H,6H2,1H3

InChI key

QEIXBXXKTUNWDK-UHFFFAOYSA-N

Application

1-(Methoxymethyl)-1H-benzotriazole can be used:
  • As a model compound in the study of photoelectron spectra of benzotriazoles, which can help in understanding their chemical reactivity.
  • To prepare a rhenium(IV) complex named [HMEBTA]2[ReIVBr6] having magnetic properties.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

新产品

Certificates of Analysis (COA)

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Self-assembly of the hexabromorhenate (IV) anion with protonated benzotriazoles: X-ray structure and magnetic properties
Martinez-Lillo J, et al.
Crystal Growth & Design, 14(11), 5985-5990 (2014)
Structural chemistry of polycyclic heteroaromatic compounds. Part 10: photoelectron spectra and electronic structures of 1-substituted 1H-benzotriazoles
Rademacher P, et al.
Journal of Molecular Structure, 513(1-3), 47-62 (1999)

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