TERT-BUTYL3-ISOTHIOCYANATOPROPIONATE

Modify Date: 2025-09-21 10:54:27

TERT-BUTYL3-ISOTHIOCYANATOPROPIONATE Structure
TERT-BUTYL3-ISOTHIOCYANATOPROPIONATE structure
Common Name TERT-BUTYL3-ISOTHIOCYANATOPROPIONATE
CAS Number 172422-02-5 Molecular Weight 187.25900
Density 1.05 g/cm3 Boiling Point 88ºC 1mm
Molecular Formula C8H13NO2S Melting Point N/A
MSDS N/A Flash Point 113.1ºC

 Names

Name tert-Butyl 3-isothiocyanatopropionate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.05 g/cm3
Boiling Point 88ºC 1mm
Molecular Formula C8H13NO2S
Molecular Weight 187.25900
Flash Point 113.1ºC
Exact Mass 187.06700
PSA 70.75000
LogP 1.82100
Vapour Pressure 0.0103mmHg at 25°C
Index of Refraction 1.485
InChIKey HEWUEFIMRQQSSL-UHFFFAOYSA-N
SMILES CC(C)(C)OC(=O)CCN=C=S

 Safety Information

Risk Phrases R20/21/22
Safety Phrases S26
RIDADR UN 2810
HS Code 2930909090

 Customs

HS Code 2930909090
Summary 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Synonyms

tert-butyl 3-isothiocyanatopropanoate
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