ChemicalBook--->CAS DataBase List--->5445-19-2

5445-19-2

5445-19-2 Structure

5445-19-2 Structure
IdentificationMore
[Name]

Methyl 2-bromohexanoate
[CAS]

5445-19-2
[Synonyms]

2-BROMOHEXANOIC ACID METHYL ESTER
ALPHA-BROMOHEXANOIC ACID METHYL ESTER
METHYL 2-BROMOCAPROATE
METHYL 2-BROMOHEXANOATE
METHYL ALPHA-BROMO HEXANOATE
2-BROMOHEXANOIC ACID METHYL ESTER 99%
[EINECS(EC#)]

226-643-9
[Molecular Formula]

C7H13BrO2
[MDL Number]

MFCD00045038
[Molecular Weight]

209.08
[MOL File]

5445-19-2.mol
Chemical PropertiesBack Directory
[Boiling point ]

94°C/15mmHg(lit.)
[density ]

1.289 g/mL at 20 °C(lit.)
[vapor pressure ]

32Pa at 25℃
[refractive index ]

n20/D 1.455
[Fp ]

69 °C
[storage temp. ]

Storage temp. 2-8°C
[form ]

clear liquid
[color ]

Colorless to Almost colorless
[BRN ]

1722052
[InChI]

1S/C7H13BrO2/c1-3-4-5-6(8)7(9)10-2/h6H,3-5H2,1-2H3
[InChIKey]

YGLPDRIMFIXNBI-UHFFFAOYSA-N
[SMILES]

CCCCC(Br)C(=O)OC
[LogP]

2.61 at 25℃
[CAS DataBase Reference]

5445-19-2(CAS DataBase Reference)
[EPA Substance Registry System]

5445-19-2(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[RIDADR ]

1993
[WGK Germany ]

3
[F ]

19
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29159000
[Storage Class]

10 - Combustible liquids
Hazard InformationBack Directory
[Uses]

Methyl 2-bromohexanoate was used in the synthesis of 2-butyl-2H-pyrido[3,2-b]-1,4-oxazin-3(4H)-one.
[General Description]

Methyl 2-bromohexanoate undergoes addition reaction with methyl-10-undecenoate to yield lactone and dimethyl-2-butyltridecandioate.
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

5445-19-2(sigmaaldrich)
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