Cas no 89424-04-4 (tert-Butyl 3-chloro-4-oxopiperidine-1-carboxylate)

tert-Butyl 3-chloro-4-oxopiperidine-1-carboxylate structure
89424-04-4 structure
Product Name:tert-Butyl 3-chloro-4-oxopiperidine-1-carboxylate
CAS No:89424-04-4
MF:C10H16ClNO3
MW:233.691942214966
CID:720451
PubChem ID:51051615
Update Time:2025-04-19

tert-Butyl 3-chloro-4-oxopiperidine-1-carboxylate Chemical and Physical Properties

Names and Identifiers

    • tert-Butyl 3-chloro-4-oxopiperidine-1-carboxylate
    • 1-Piperidinecarboxylicacid, 3-chloro-4-oxo-, ethyl ester
    • 3-Chloro-4-oxo-piperidine-1-carboxylic acid tert-butyl ester
    • 2-chloro-4-ethoxy-6-methylnicotinic acid ethyl ester
    • 2-chloro-4-ethoxycarbonylpiperidone
    • 3-chloro-1-ethoxycarbonyl-4-piperidone
    • 3-chloro-1-ethoxycarbonylpiperidin-4-one
    • 3-chloro-4-oxo-1-piperidinecarboxylic acid ethyl ester
    • 3-Pyridinecarboxylic acid,2-chloro-4-ethoxy-6-methyl-,ethyl ester
    • ethyl 3-chloro-4-oxo-1-piperidinecarboxylate
    • SB38858
    • MFCD08234811
    • MB05745
    • tert-butyl 3-chloro-4-oxo-piperidine-1-carboxylate
    • A840158
    • SCHEMBL3117816
    • 1-Boc-3-chloropiperidin-4-one
    • CS-0331002
    • tert-Butyl3-chloro-4-oxopiperidine-1-carboxylate
    • FXESQZCEOYWZJH-UHFFFAOYSA-N
    • 3-Chloro-4-oxo-1-piperidinecarboxylic acid 1,1-dimethylethyl ester
    • SY345153
    • FT-0601873
    • AT13174
    • 89424-04-4
    • 815575-86-1
    • 3-Chloro-4-oxo-piperidine-1-carboxylic acid t-butyl ester
    • Inchi： 1S/C10H16ClNO3/c1-10(2,3)15-9(14)12-5-4-8(13)7(11)6-12/h7H,4-6H2,1-3H3
    • InChI Key： FXESQZCEOYWZJH-UHFFFAOYSA-N
    • SMILES： ClC1C(CCN(C(=O)OC(C)(C)C)C1)=O

Computed Properties

  • Exact Mass: 233.08200
  • Monoisotopic Mass: 233.082
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 272
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 3
  • XLogP3: 1.3
  • Topological Polar Surface Area: 46.6A^2

Experimental Properties

  • Density: 1.199g/cm3
  • Boiling Point: 335.328oC at 760 mmHg
  • Flash Point: 156.601oC
  • Refractive Index: 1.496
  • PSA: 46.61000
  • LogP: 1.74160

tert-Butyl 3-chloro-4-oxopiperidine-1-carboxylate Customs Data

  • HS CODE：2933399090
  • Customs Data：

    China Customs Code:

    2933399090

    Overview:

    2933399090. Other compounds with non fused pyridine rings in structure. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

tert-Butyl 3-chloro-4-oxopiperidine-1-carboxylate Related Literature

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