Cas no 28001-58-3 (Phenyltrimethylammonium methosulfate)

Phenyltrimethylammonium methosulfate structure
28001-58-3 structure
Product Name:Phenyltrimethylammonium methosulfate
CAS No:28001-58-3
MF:C10H17NO4S
MW:247.311281919479
CID:88751
PubChem ID:5284510
Update Time:2025-04-18

Phenyltrimethylammonium methosulfate Chemical and Physical Properties

Names and Identifiers

    • Phenyltrimethylammonium methosulfate
    • methyl sulfate,trimethyl(phenyl)azanium
    • N,N,N-trimethylanilinium methyl sulfate
    • trimethylphenylammonium methyl sulfate
    • Tri-N-methyl-anilinium,Methylsulfate
    • N6ETI313C1
    • methyl sulfate;trimethyl(phenyl)azanium
    • Phenyltrimethylammonium sulfomethylate
    • 2-(2-N-BOC-PYRROLE)BENZOICACID
    • Q27893862
    • UNII-N6ETI313C1
    • Benzenaminium, N,N,N-trimethyl-, methyl sulfate (1:1)
    • PHENYLTRIMETHYLAMMONIUMMETHOSULFATE
    • A819278
    • 28001-58-3
    • methyl sulfate; trimethyl(phenyl)ammonium
    • SCHEMBL2531547
    • N,N,N-trimethylbenzenaminium methyl sulfate
    • FT-0638742
    • DTXSID9022281
    • DTXCID402281
    • DB-047317
    • MDL: MFCD00011792
    • Inchi: 1S/C9H14N.CH4O4S/c1-10(2,3)9-7-5-4-6-8-9;1-5-6(2,3)4/h4-8H,1-3H3;1H3,(H,2,3,4)/q+1;/p-1
    • InChI Key: FVPMMSKYNHPFOI-UHFFFAOYSA-M
    • SMILES: S(=O)(=O)([O-])OC.[N+](C)(C)(C)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 247.08800
  • Monoisotopic Mass: 247.087829
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 187
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 74.8

Experimental Properties

  • Color/Form: Odorless white crystals
  • Melting Point: 123-125°C
  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • PSA: 74.81000
  • LogP: 2.05710
  • Sensitiveness: Hygroscopic
  • Solubility: Not determined

Phenyltrimethylammonium methosulfate Security Information

  • Hazardous Material transportation number:UN2811
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26; S36/37/39
  • HazardClass:6.1
  • PackingGroup:III
  • Risk Phrases:R36/37/38
  • Packing Group:III
  • Safety Term:6.1
  • Packing Group:III
  • Hazard Level:6.1

Phenyltrimethylammonium methosulfate Customs Data

  • HS CODE:2923900090
  • Customs Data:

    China Customs Code:

    2923900090

    Overview:

    2923900090 Other quaternary ammonium salts and quaternary ammonium bases.Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:6.5%.general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2923900090 other quaternary ammonium salts and hydroxides.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:6.5%.General tariff:30.0%

Phenyltrimethylammonium methosulfate Pricemore >>

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