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1974-04-5

1974-04-5 Structure

1974-04-5 Structure
IdentificationMore
[Name]

2-Bromoheptane
[CAS]

1974-04-5
[Synonyms]

2-BROMOHEPTANE
2-bromo-heptan
2-Heptyl bromide
2-heptylbromide
heptane,2-bromo-
2-BROMOHEPTANE, TECH.
1-methylhexyl bromide
[EINECS(EC#)]

217-824-3
[Molecular Formula]

C7H15Br
[MDL Number]

MFCD00000164
[Molecular Weight]

179.1
[MOL File]

1974-04-5.mol
Chemical PropertiesBack Directory
[Melting point ]

47°C
[Boiling point ]

64-66 °C/21 mmHg (lit.)
[density ]

1.142 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.447(lit.)
[Fp ]

117 °F
[BRN ]

1731556
[InChI]

InChI=1S/C7H15Br/c1-3-4-5-6-7(2)8/h7H,3-6H2,1-2H3
[InChIKey]

HLAUCEOFCOXKNF-UHFFFAOYSA-N
[SMILES]

CC(Br)CCCCC
[CAS DataBase Reference]

1974-04-5(CAS DataBase Reference)
[NIST Chemistry Reference]

Heptane, 2-bromo-(1974-04-5)
[EPA Substance Registry System]

1974-04-5(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R10:Flammable.
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S16:Keep away from sources of ignition-No smoking .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

UN 1993 3/PG 3
[WGK Germany ]

3
[TSCA ]

TSCA listed
[HazardClass ]

3.2
[PackingGroup ]

III
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Eye Irrit. 2
Flam. Liq. 3
Skin Irrit. 2
STOT SE 3
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2-Bromoheptane(1974-04-5).msds
Hazard InformationBack Directory
[Uses]

2-Bromoheptane has been used in the preparation of:
  • racemic alcohol, 2-methylheptanol
  • glutathione (GSH) derivatives
  • GSH analog that contains tetrazole isostere (Tet-sHep)
Spectrum DetailBack Directory
[Spectrum Detail]

2-Bromoheptane(1974-04-5)1HNMR
2-Bromoheptane(1974-04-5)IR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

1974-04-5(sigmaaldrich)
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