Cas no 3395-81-1 (1-Chloro-4-(dimethoxymethyl)benzene)

1-Chloro-4-(dimethoxymethyl)benzene is a chlorinated aromatic compound featuring a dimethoxymethyl functional group. This structure imparts unique reactivity, making it a valuable intermediate in organic synthesis, particularly in the preparation of pharmaceuticals, agrochemicals, and specialty chemicals. The presence of both an electron-withdrawing chloro substituent and an electron-donating dimethoxymethyl group allows for selective functionalization, enhancing its utility in cross-coupling reactions and nucleophilic substitutions. Its stability under standard conditions ensures ease of handling and storage. The compound’s versatility in synthetic pathways underscores its importance in fine chemical manufacturing, where precise control over molecular architecture is required.
1-Chloro-4-(dimethoxymethyl)benzene structure
3395-81-1 structure
Product Name:1-Chloro-4-(dimethoxymethyl)benzene
CAS No:3395-81-1
MF:C9H11ClO2
MW:186.635442018509
CID:295543
PubChem ID:24873254
Update Time:2025-06-07

1-Chloro-4-(dimethoxymethyl)benzene Chemical and Physical Properties

Names and Identifiers

    • 1-Chloro-4-(dimethoxymethyl)benzene
    • 1-CHLORO-4-DIMETHOXYMETHYL-BENZENE
    • Benzene,1-chloro-4-(dimethoxymethyl)-
    • 4-Chlorobenzaldehyde dimethyl acetal
    • Benzene,4-chloro-1-(dimethoxymethyl)
    • p-chlorobenzaldehyde dimethyl acetal
    • p-ClC6H4CH(OMe)2
    • Benzene, 4-chloro-1-(dimethoxymethyl)-
    • AKOS015964299
    • SCHEMBL654510
    • LS-12487
    • FT-0634828
    • 4-Chlorobenzaldehyde dimethyl acetal, 98%
    • 3395-81-1
    • DTXSID70334420
    • 1-chloro-4-(dimethoxy-methyl)-benzene
    • 4-CHLOROBENZALDEHYDEDIMETHYLACETAL9&
    • J-019396
    • 4-CHLOROBENZALDEHYDE DIMETHYL ACETAL 9&
    • DB-048534
    • ALBB-033141
    • MDL: MFCD00045210
    • Inchi: 1S/C9H11ClO2/c1-11-9(12-2)7-3-5-8(10)6-4-7/h3-6,9H,1-2H3
    • InChI Key: YRNBYTFFWMWTGG-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(=CC=1)C(OC)OC

Computed Properties

  • Exact Mass: 186.04500
  • Monoisotopic Mass: 186.045
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 118
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 18.5A^2
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 2.2

Experimental Properties

  • Color/Form: Not determined
  • Density: 1.128?g/mL?at 25?°C(lit.)
  • Boiling Point: 114-115?°C/19?mmHg(lit.)
  • Flash Point: 215?°F
  • Refractive Index: n20/D 1.508(lit.)
  • PSA: 18.46000
  • LogP: 2.63140
  • Solubility: Not determined

1-Chloro-4-(dimethoxymethyl)benzene Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H302
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Hazard Category Code: 22
  • Hazardous Material Identification: Xn

1-Chloro-4-(dimethoxymethyl)benzene Pricemore >>

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