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79218-15-8

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79218-15-8 Structure

79218-15-8 Structure
IdentificationBack Directory
[Name]

TERT-BUTYL CROTONATE
[CAS]

79218-15-8
[Synonyms]

DESCRIPTION
ert-ButylCrotonate
tert-Butyl Crotonate >
tert-Butyl (E)-but-2-enoate
tert-Butyl Crotonate
tert-Butyl (E)-2-butenoate
Crotonsure-tert.-butylester
tert-Butyl crotonate >=97.0%
(E)-Crotonic acid tert-butyl ester
(E)-2-butenoic acid tert-butyl ester
TERT-BUTYL CROTONATE ISO 9001：2015 REACH
2-Butenoic acid,1,1-diMethylethyl ester, (2E)-
[Molecular Formula]

C8H14O2
[MDL Number]

MFCD00059055
[MOL File]

79218-15-8.mol
[Molecular Weight]

142.2
Chemical PropertiesBack Directory
[Boiling point ]

82 °C / 97mmHg
[density ]

0,89 g/cm3
[refractive index ]

n20/D 1.425
[Fp ]

23 °C
[storage temp. ]

Refrigerator
[solubility ]

Chloroform (Soluble), Methanol (Soluble)
[form ]

clear liquid
[color ]

Colorless to Almost colorless
[Specific Gravity]

0.89
[InChI]

1S/C8H14O2/c1-5-6-7(9)10-8(2,3)4/h5-6H,1-4H3/b6-5+
[InChIKey]

QHSPZGZEUDEIQM-AATRIKPKSA-N
[SMILES]

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

Xi
[Risk Statements ]

10-41
[Safety Statements ]

16-39-26
[RIDADR ]

3272
[WGK Germany ]

3
[HazardClass ]

3
[PackingGroup ]

III
[HS Code ]

29161900
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Eye Dam. 1
Flam. Liq. 3
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

tert-Butyl (3S)-3-aminobutanoate-->tert-Butyl 3-butenoate
Questions And AnswerBack Directory
[Application]

tert-butyl crotonate is a widely used chemical raw material, among which tert-butyl crotonate is frequently used to synthesize chiral tert-butyl β-aminobutyrate.
Spectrum DetailBack Directory
[Spectrum Detail]

TERT-BUTYL CROTONATE(79218-15-8)1HNMR
TERT-BUTYL CROTONATE(79218-15-8)IR1
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