Cas no 774234-25-2 (Tert-butyl 3-iodopyrrolidine-1-carboxylate)

Tert-butyl 3-iodopyrrolidine-1-carboxylate structure
774234-25-2 structure
Product Name:Tert-butyl 3-iodopyrrolidine-1-carboxylate
CAS No:774234-25-2
MF:C9H16INO2
MW:297.133315086365
MDL:MFCD12031283
CID:822035
PubChem ID:23251108
Update Time:2025-04-19

Tert-butyl 3-iodopyrrolidine-1-carboxylate Chemical and Physical Properties

Names and Identifiers

    • tert-Butyl 3-iodopyrrolidine-1-carboxylate
    • 1-(TERT-BUTOXYCARBONYL)-3-IODOPYRROLIDINE
    • 1-Boc-3-iodopyrrolidine
    • 3-Iodo-pyrrolidine-1-carboxylic acid tert-butyl ester
    • N-BOC-3-Iodopyrrolidine
    • 1-Boc-3-iodo-pyrrolidine
    • HT932
    • 1-PYRROLIDINECARBOXYLIC ACID, 3-IODO-, 1,1-DIMETHYLETHYL ESTER
    • (S)-TERT-BUTYL 3-IODOPYRROLIDINE-1-CARBOXYLATE
    • C9H16INO2
    • PB15047
    • FCH1409577
    • AM20100768
    • (S)-1-Boc-3-iodopyrrolidine
    • tert-Butyl 3-iodopyrrolidine-1-carboxylate;1-Boc-3-iodopyrrolidine
    • EN300-179876
    • 774234-25-2
    • (R)-1-BOC-3-IODOPYRROLIDINE
    • SY320944
    • SY066181
    • MFCD12031283
    • FT-0684757
    • SY029315
    • A865247
    • SCHEMBL1484887
    • tert-butyl3-iodopyrrolidine-1-carboxylate
    • DTXSID80631558
    • MFCD17015907
    • FT-0770825
    • MFCD17015908
    • AKOS015919397
    • PB22824
    • J-503642
    • CFTPTQLIAIOWLK-UHFFFAOYSA-N
    • DS-14130
    • PB25606
    • DA-17306
    • Tert-butyl 3-iodopyrrolidine-1-carboxylate
    • MDL: MFCD12031283
    • Inchi: 1S/C9H16INO2/c1-9(2,3)13-8(12)11-5-4-7(10)6-11/h7H,4-6H2,1-3H3
    • InChI Key: CFTPTQLIAIOWLK-UHFFFAOYSA-N
    • SMILES: IC1CN(C(=O)OC(C)(C)C)CC1

Computed Properties

  • Exact Mass: 297.02300
  • Monoisotopic Mass: 297.02258g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 200
  • 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: 29.5
  • XLogP3: 2.2

Experimental Properties

  • Boiling Point: 300.7±35.0℃ at 760 mmHg
  • PSA: 29.54000
  • LogP: 2.36870

Tert-butyl 3-iodopyrrolidine-1-carboxylate Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. 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:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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