ChemicalBook--->CAS DataBase List--->14036-55-6

14036-55-6

14036-55-6 Structure

14036-55-6 Structure
IdentificationBack Directory
[Name]

TERT-BUTYL 3-BUTENOATE
[CAS]

14036-55-6
[Synonyms]

3-butenoate
ert-Butyl3-Butenoate
tert-Butyl but-3-enoate
tert-Butyl 3-Butenoate >
3-butenoic acid tert-butyl ester
Vinylacetic Acid tert-Butyl Ester
tert-Butyl 3-butenoate >=98.0% (GC)
3-Butenoic acid, 1,1-dimethylethyl ester
3-Butenoic Acid tert-Butyl Ester tert-Butyl Vinylacetate Vinylacetic Acid tert-Butyl Ester
[EINECS(EC#)]

628-486-5
[Molecular Formula]

C8H14O2
[MDL Number]

MFCD06411714
[MOL File]

14036-55-6.mol
[Molecular Weight]

142.2
Chemical PropertiesBack Directory
[Boiling point ]

154.1±9.0 °C(Predicted)
[density ]

0.877 g/mL at 20 °C
[refractive index ]

n20/D 1.413
[Fp ]

31 °C
[storage temp. ]

2-8°C
[form ]

clear liquid
[color ]

Colorless to Almost colorless
[InChI]

InChI=1S/C8H14O2/c1-5-6-7(9)10-8(2,3)4/h5H,1,6H2,2-4H3
[InChIKey]

NGASWKRTXGWPNN-UHFFFAOYSA-N
[SMILES]

C(OC(C)(C)C)(=O)CC=C
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)Exclamation Mark (GHS07)
GHS02,GHS07
[Signal word ]

Warning
[Hazard statements ]

H226-H302-H315-H319-H335
[Precautionary statements ]

P210-P233-P240-P301+P312-P303+P361+P353-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

10-22-36/37/38
[Safety Statements ]

26
[RIDADR ]

UN 3272 3/PG 3
[WGK Germany ]

3
[F ]

10-23
[HazardClass ]

3
[PackingGroup ]

III
[HS Code ]

29161900
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Flam. Liq. 3
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

Colorless liquid
[Uses]

tert-Butyl 3-Butenoate is used as a reagent in the synthesis of (-)-exiguolide, a marine sponge macrolide that specifically inhibited fertilization of sea urchin (Hemicentrotus pulcherrimus) gametes but not embryogenesis of the fertilized egg.
Spectrum DetailBack Directory
[Spectrum Detail]

TERT-BUTYL 3-BUTENOATE(14036-55-6)1HNMR
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