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595597-00-5

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595597-00-5 Structure

595597-00-5 Structure
IdentificationBack Directory
[Name]

Carbamic acid, (tetrahydro-2H-thiopyran-4-yl)-, 1,1-dimethylethyl ester (9CI)
[CAS]

595597-00-5
[Synonyms]

synthesis-13
synthesis-13-001
tert-butyl N-(thian-4-yl)carbamate
tert-Butyl N-tetrahydrothiopyran-4-ylcarbamate
tert-butyl tetrahydro-2H-thiopyran-4-ylcarbaMate
1,1-Dimethylethyl N-[tetrahydro-2H-thiopyran-4-yl]carbamate
CarbaMic acid, (tetrahydro-2h-thiopyran-4-yl)-, 1,1-diMethylethyl ester
Carbamic acid, N-(tetrahydro-2H-thiopyran-4-yl)-, 1,1-dimethylethyl ester
Carbamic acid, (tetrahydro-2H-thiopyran-4-yl)-, 1,1-dimethylethyl ester (9CI)
[Molecular Formula]

C10H19NO2S
[MDL Number]

MFCD16659876
[MOL File]

595597-00-5.mol
[Molecular Weight]

217.33
Chemical PropertiesBack Directory
[Boiling point ]

331.5±31.0 °C(Predicted)
[density ]

1.07±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C, stored under nitrogen
[form ]

solid
[pka]

12.15±0.20(Predicted)
[Appearance]

White to off-white Solid
[InChI]

1S/C10H19NO2S/c1-10(2,3)13-9(12)11-8-4-6-14-7-5-8/h8H,4-7H2,1-3H3,(H,11,12)
[InChIKey]

IRZQBMIZGJSXFN-UHFFFAOYSA-N
[SMILES]

O=C(OC(C)(C)C)NC1CCSCC1
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22
[WGK Germany ]

WGK 3
[HS Code ]

2934999090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Spectrum DetailBack Directory
[Spectrum Detail]

Carbamic acid, (tetrahydro-2H-thiopyran-4-yl)-, 1,1-dimethylethyl ester (9CI)(595597-00-5)1HNMR
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