ChemicalBook--->CAS DataBase List--->3070-53-9

3070-53-9

3070-53-9 Structure

3070-53-9 Structure
IdentificationMore
[Name]

1,6-Heptadiene
[CAS]

3070-53-9
[Synonyms]

1,6-HEPTADIENE
CH2=CH(CH2)3CH=CH2
1,6-HEPTADIENE 99%
1,6-HEPTADIENE 98% MIN.
1,5-HEPTADIENE 99%
[EINECS(EC#)]

601-283-9
[Molecular Formula]

C7H12
[MDL Number]

MFCD00008667
[Molecular Weight]

96.17
[MOL File]

3070-53-9.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless liquid
[Melting point ]

-129.4--129 °C (lit.)
[Boiling point ]

89-90 °C (lit.)
[density ]

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

n20/D 1.414(lit.)
[Fp ]

-10 °C
[storage temp. ]

2-8°C
[form ]

clear liquid
[color ]

Colorless to Almost colorless
[Water Solubility ]

44mg/L(25 ºC)
[BRN ]

1731760
[InChI]

1S/C7H12/c1-3-5-7-6-4-2/h3-4H,1-2,5-7H2
[InChIKey]

GEAWFZNTIFJMHR-UHFFFAOYSA-N
[SMILES]

C=CCCCC=C
[CAS DataBase Reference]

3070-53-9(CAS DataBase Reference)
[EPA Substance Registry System]

1,6-Heptadiene (3070-53-9)
Safety DataBack Directory
[Hazard Codes ]

F,Xn
[Risk Statements ]

R11:Highly Flammable.
R36/37/38:Irritating to eyes, respiratory system and skin .
R65:Harmful: May cause lung damage if swallowed.
[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 .
S62:If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label .
[RIDADR ]

UN 3295 3/PG 2
[WGK Germany ]

3
[TSCA ]

TSCA listed
[HS Code ]

2901.29.5000
[HazardClass ]

3.1
[PackingGroup ]

II
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Asp. Tox. 1
Eye Irrit. 2
Flam. Liq. 2
Skin Irrit. 2
STOT SE 3
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1,6-heptadiene(3070-53-9).msds
Hazard InformationBack Directory
[Chemical Properties]

clear colorless liquid
[Uses]

1,6-Heptadiene has been used as a starting reagent in asymmetric synthesis of all stereoisomers of 6-methylpipecolic acids.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 100, p. 7089, 1978 DOI: 10.1021/ja00490a065
[General Description]

Highly stereoselective and regiospecific living coordination polymerization of 1,6-heptadiene has been used to generate a spectrum of different physical forms of poly(1,3-methylenecyclohexane).
Spectrum DetailBack Directory
[Spectrum Detail]

1,6-Heptadiene(3070-53-9)MS
1,6-Heptadiene(3070-53-9)1HNMR
1,6-Heptadiene(3070-53-9)13CNMR
1,6-Heptadiene(3070-53-9)IR1
1,6-Heptadiene(3070-53-9)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

3070-53-9(sigmaaldrich)
[TCI AMERICA]

1,6-Heptadiene,>99.0%(GC)(3070-53-9)
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