ChemicalBook--->CAS DataBase List--->6938-26-7

6938-26-7

6938-26-7 Structure

6938-26-7 Structure
IdentificationBack Directory
[Name]

DL-ALPHA-HYDROXYVALERIC ACID ETHYL ESTER
[CAS]

6938-26-7
[Synonyms]

Einecs 230-066-8
ETHYL 2-HYDROXYVALERATE
ETHYL 2-HYDROXYPENTANOATE
ETHYL-DL-2-HYDROXYVALERATE
ETHYL (+/-)-2-HYDROXYVALERATE
DL-ETHYL-ALPHA-HYDROXY VALERATE
Ethyl 2-hydroxyvalerate >=97.0%
2-HYDROXYVALERIC ACID ETHYL ESTER
DL-2-HYDROXYPENTANOIC ACID ETHYL ESTER
DL-ALPHA-HYDROXYVALERIC ACID ETHYL ESTER
DL-α-Hydroxyvaleric acid ethyl ester, DL-2-Hydroxypentanoic acid ethyl ester
Ethyl 2-Hydroxypentanoate 2-Hydroxyvaleric Acid Ethyl Ester 2-Hydroxypentanoic Acid Ethyl Ester
[EINECS(EC#)]

230-066-8
[Molecular Formula]

C7H14O3
[MDL Number]

MFCD00042730
[MOL File]

6938-26-7.mol
[Molecular Weight]

146.18
Chemical PropertiesBack Directory
[Boiling point ]

190 °C
[density ]

0.983 g/mL at 20 °C(lit.)
[refractive index ]

n20/D 1.421
[Fp ]

61 °C
[storage temp. ]

2-8°C
[form ]

Liquid
[pka]

13.21±0.20(Predicted)
[BRN ]

1721587
[InChI]

1S/C7H14O3/c1-3-5-6(8)7(9)10-4-2/h6,8H,3-5H2,1-2H3
[InChIKey]

MQGTZMCASHTGBJ-UHFFFAOYSA-N
[SMILES]

CCCC(O)C(=O)OCC
[LogP]

0.980 (est)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

3
[HS Code ]

29181990
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

Ethyl 2-Hydroxypentanoate is an intermediate used to prepare 6-(2,4-diaminopyrimidinyl)-1,4-benzoxazin-3-ones as small molecule renin inhibitors.
Spectrum DetailBack Directory
[Spectrum Detail]

DL-ALPHA-HYDROXYVALERIC ACID ETHYL ESTER(6938-26-7)MS
DL-ALPHA-HYDROXYVALERIC ACID ETHYL ESTER(6938-26-7)13CNMR
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