ethyl 4-isothiocyanatopiperidine-1-carboxylate

Modify Date: 2024-02-16 17:18:26

ethyl 4-isothiocyanatopiperidine-1-carboxylate Structure
ethyl 4-isothiocyanatopiperidine-1-carboxylate structure
Common Name ethyl 4-isothiocyanatopiperidine-1-carboxylate
CAS Number 73733-70-7 Molecular Weight 214.28500
Density 1.21g/cm3 Boiling Point 332.7ºC at 760 mmHg
Molecular Formula C9H14N2O2S Melting Point N/A
MSDS N/A Flash Point 155ºC

 Names

Name ethyl 4-isothiocyanatopiperidine-1-carboxylate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.21g/cm3
Boiling Point 332.7ºC at 760 mmHg
Molecular Formula C9H14N2O2S
Molecular Weight 214.28500
Flash Point 155ºC
Exact Mass 214.07800
PSA 73.99000
LogP 1.64800
Index of Refraction 1.571
InChIKey LKKAWMNEPUOSKW-UHFFFAOYSA-N
SMILES CCOC(=O)N1CCC(N=C=S)CC1

 Safety Information

HS Code 2933399090

 Synthetic Route

~40%

ethyl 4-isothiocyanatopiperidine-1-carboxylate Structure

ethyl 4-isothio...

CAS#:73733-70-7

Literature: PFIZER INC. Patent: WO2004/74283 A1, 2004 ; Location in patent: Page 33; 34; 219 ; WO 2004/074283 A1

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ethyl 4-isothiocyanatopiperidine-1-carboxylate Structure

ethyl 4-isothio...

CAS#:73733-70-7

Literature: Janssen Pharmaceutica N.V. Patent: US4943580 A1, 1990 ;

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ethyl 4-isothiocyanatopiperidine-1-carboxylate Structure

ethyl 4-isothio...

CAS#:73733-70-7

Literature: Janssens; Torremans; Janssen; Stokbroekx; Luyckx Journal of Medicinal Chemistry, 1985 , vol. 28, # 12 p. 1925 - 1933

 Customs

HS Code 2933399090
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%

 Synonyms

4-isothiocyanato-1-piperidinecarboxylate
4-isothiocyanato-1-piperidinecarboxylic acid ethyl ester
EINECS 277-579-3
4-isothiocyanato-piperidin-1-carboxylic acid ethyl ester
ethyl 4-isothiocyanato-1-piperidinecarboxylate
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