2,3,4-Trimethoxyphenylacetonitrile structure

2,3,4-Trimethoxyphenylacetonitrile

2-(2,3,4-trimethoxyphenyl)acetonitrile

Also Known As: 2,3,4-Trimethoxyphenylacetonitrile|2-(2,3,4-trimethoxyphenyl)acetonitrile|trimethoxy phenyl acetonitrile|(2,3,4-trimethoxyphenyl)acetonitrile|2,3,4-trimethoxyphenyl-acetonitrile|(4-Chlorophenyl)(phenyl)methanamine|8167AE|2,3,4-Trimethoxyphenylacetonitrile; 98%|Benzeneacetonitrile,2,3,4-trimethoxy-|FS-5455|Benzeneacetonitrile, 2,3,4-trimethoxy-|I14-28980

CAS: 68913-85-9
Molecular Formula C11H13NO3
Molecular Weight 207.08954 g/mol
LogP 1.4
Topological Polar Surface Area 51.5 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 207.08954
Monoisotopic Mass 207.08954
Heavy Atoms 15
Complexity 235.0

Chemical Identifiers

CAS Number 68913-85-9
SMILES COC1=C(C(=C(C=C1)CC#N)OC)OC
InChIKey RZVUKELRMABJPI-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.

Analytical Reagents (2 patents) Biotechnology (6 patents) Heterocyclic Building Blocks (13 patents) Organic Building Blocks (4 patents) Peptides & Amino Acids (4 patents) Pharmaceutical Intermediates (15 patents) Specialty Chemicals (9 patents)

Product Overview

2,3,4-Trimethoxyphenylacetonitrile (CAS 68913-85-9), with molecular formula C11H13NO3 and molecular weight 207.08954 g/mol. IUPAC: 2-(2,3,4-trimethoxyphenyl)acetonitrile.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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