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1-Hepten-3-ol

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Name

1-Hepten-3-ol

EINECS 225-579-9
CAS No. 4938-52-7 Density 0.833 g/cm3
PSA 20.23000 LogP 1.72350
Solubility N/A Melting Point 26°C (estimate)
Formula C7H14O Boiling Point 154.5 °C at 760 mmHg
Molecular Weight 114.188 Flash Point 48.8 °C
Transport Information UN 1987 Appearance liquid
Safety 16-26-36/37/39 Risk Codes 10-36/37/38
Molecular Structure Molecular Structure of 4938-52-7 (1-Hepten-3-ol) Hazard Symbols IrritantXi
Synonyms

(?à)-1-Hepten-3-ol;1-Vinylpentanol;NSC 93797;

Article Data 82

1-Hepten-3-ol Specification

The 1-Hepten-3-ol , its cas register number is 4938-52-7. The IUPAC name about this chemicals is Hept-1-en-3-ol .It has other registry number is 67928-91-0. Following are the physical and chemical properties about it: (1)Index of Refraction: 1.434 (2)Molar Refractivity: 35.69 cm3 (3)Molar Volume: 137 cm3  (4)Surface Tension: 27.4 dyne/cm (5)Enthalpy of Vaporization: 45.57 kJ/mol (6)Vapour Pressure: 1.16 mmHg at 25°C (7) Refractive index: n20/D 1.433(lit.) .

The 1-Hepten-3-ol is a stable and flammable liduid. It is sensitive to air. It incompatible with strong oxidizing agents. It irritating to eyes, respiratory system and skin, so if you want to use it, need to wear suitable protective clothing, gloves and eye/face protection, also we need keep away from sources of ignition, and in case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Expect these measures, it also have some importent sfety imformations, RIDADR about it is UN 1987 3/PG 3, WGK Germany is 3, HazardClass is 3 and PackingGroup is III .

If you want to sotre this chemicals, please keep containers tightly sealed, and store in cool, dry place in tighely closed containers, also ensure good ventilation/exhaustion at the workplace.Follow are some neasures about first aid, after inhalation, sopply fresh air, if required,provide artificial respiration and keep patient warm.After skin contact, seek immediate medical advice and instantly wash with water, soap and rinse thoroughly.

This chemicals can be described computed from structure: 
1) Canonical SMILES: CCCCC(C=C)O
2) InChI: InChI=1S/C7H14O/c1-3-5-6-7(8)4-2/h4,7-8H,2-3,5-6H2,1H3
3) InChIKey: PZKFYTOLVRCMOA-UHFFFAOYSA-N

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