Cas no 78551-93-6 (tert-butyl 3-(2-methylpropyl)piperazine-1-carboxylate)

tert-butyl 3-(2-methylpropyl)piperazine-1-carboxylate structure
78551-93-6 structure
Product Name:tert-butyl 3-(2-methylpropyl)piperazine-1-carboxylate
CAS No:78551-93-6
MF:C13H26N2O2
MW:242.357743740082
MDL:MFCD08273962
CID:562292
PubChem ID:13520372
Update Time:2025-04-19

tert-butyl 3-(2-methylpropyl)piperazine-1-carboxylate Chemical and Physical Properties

Names and Identifiers

    • tert-Butyl 3-isobutylpiperazine-1-carboxylate
    • 1-BOC-3-ISOBUTYL-PIPERAZINE
    • 1-Piperazinecarboxylic acid, 3-(2-methylpropyl)-, 1,1- dimethylethyl ester
    • 3-(2-Methylpropyl)-1-piperazinecarboxylic acid tert-butyl ester
    • 3-ISOBUTYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
    • 1-BOC-3-ISOBUTYLPIPERAZINE
    • tert-butyl 3-(2-methylpropyl)piperazine-1-carboxylate
    • 1-N-BOC-3-ISOBUTYLPIPERAZINE
    • VP70198
    • AB44491
    • AB0073238
    • A26046
    • 1-Piperazinecarboxylicacid, 3-(2-methylpropyl)-, 1,1-dimethylethyl ester
    • AB42219
    • tert-butyl3-isobutylpiperazine-1-carboxylate
    • CS-B0419
    • DTXSID00542839
    • SCHEMBL10219114
    • MFCD08273962
    • FT-0660129
    • FT-0660130
    • AKOS005258457
    • FT-0660100
    • 78551-93-6
    • AB42222
    • EN300-1877546
    • DIETHYLMALONATE-D2
    • AS-35475
    • DB-002997
    • MDL： MFCD08273962
    • Inchi： 1S/C13H26N2O2/c1-10(2)8-11-9-15(7-6-14-11)12(16)17-13(3,4)5/h10-11,14H,6-9H2,1-5H3
    • InChI Key： LSZJZDBPJNYEIE-UHFFFAOYSA-N
    • SMILES： O(C(C)(C)C)C(N1CCNC(CC(C)C)C1)=O

Computed Properties

  • Exact Mass: 242.19900
  • Monoisotopic Mass: 242.199428076g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 259
  • 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
  • Topological Polar Surface Area: 41.6
  • XLogP3: 2.2

Experimental Properties

  • Density: 0.962
  • Boiling Point: 315.5°C at 760 mmHg
  • Flash Point: 144.6°C
  • Refractive Index: 1.458
  • PSA: 41.57000
  • LogP: 2.50810

tert-butyl 3-(2-methylpropyl)piperazine-1-carboxylate Security Information

tert-butyl 3-(2-methylpropyl)piperazine-1-carboxylate Customs Data

  • HS CODE：2933599090
  • Customs Data：

    China Customs Code:

    2933599090

    Overview:

    2933599090. Other compounds with pyrimidine ring in structure(Including other compounds with piperazine ring on the 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:

    2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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