Cas no 93951-72-5 (4-Chloro-3-methylphenol-2,6-d2)

4-Chloro-3-methylphenol-2,6-d2 structure
93951-72-5 structure
Product Name:4-Chloro-3-methylphenol-2,6-d2
CAS No:93951-72-5
MF:C7H7ClO
MW:144.595204591751
MDL:MFCD00143297
CID:803598
PubChem ID:16217390
Update Time:2025-08-03

4-Chloro-3-methylphenol-2,6-d2 Chemical and Physical Properties

Names and Identifiers

    • Phen-2,6-d2-ol,4-chloro-3-methyl- (9CI)
    • 4-CHLORO-3-METHYLPHENOL-2,6-D2
    • 4-Chloro-3-methylphenol-2,6-d21000μg
    • 4-Chloro-3-methylphenol-2,6-d2, 98 atom % D
    • 4-Chloro-3-methylphenol D2 (2,6-D2)
    • 93951-72-5
    • D99328
    • 4-Chloro-3-methyl(2,6-~2~H_2_)phenol
    • Phen-2,6-d2-ol,4-chloro-3-methyl-(9ci)
    • 4-chloro-2,6-dideuterio-3-methylphenol
    • 4-chloro-3-methylphenol-d2
    • DTXSID40584359
    • Phen-2,6-d2-ol, 4-chloro-3-methyl- (9CI); 4-Chloro-3-methylphenol (ring-2,6-D2); 4-Chloro-3-methylphenol-2,6-D2; 4-Chloro-2,6-dideuterio-3-methylphenol
    • 4-Chloro-3-methylphenol-2,6-d2
    • MDL: MFCD00143297
    • Inchi: 1S/C7H7ClO/c1-5-4-6(9)2-3-7(5)8/h2-4,9H,1H3/i2D,4D
    • InChI Key: CFKMVGJGLGKFKI-XRIVEGAOSA-N
    • SMILES: ClC1=CC([2H])=C(C([2H])=C1C)O

Computed Properties

  • Exact Mass: 144.0310960g/mol
  • Monoisotopic Mass: 144.0310960g/mol
  • Isotope Atom Count: 2
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 94.9
  • 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
  • XLogP3: 3.1
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • Melting Point: 63-65?°C(lit.)
  • Boiling Point: 235?°C(lit.)

4-Chloro-3-methylphenol-2,6-d2 Security Information

  • Hazardous Material transportation number:UN 3437 6.1/PG 2
  • WGK Germany:2
  • Hazard Category Code: 21/22-41-43-50
  • Safety Instruction: 26-36/37/39-61
  • RTECS:GO7100000
  • Hazardous Material Identification: Xn N

4-Chloro-3-methylphenol-2,6-d2 Pricemore >>

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