428973
1-Hepten-3-ol
97%
Synonym(s):
Butyl vinyl carbinol
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About This Item
Linear Formula:
CH3(CH2)3CH(OH)CH=CH2
CAS Number:
Molecular Weight:
114.19
Beilstein:
1720340
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
Assay
97%
refractive index
n20/D 1.433 (lit.)
bp
153-156 °C (lit.)
density
0.836 g/mL at 20 °C
0.836 g/mL at 25 °C (lit.)
SMILES string
CCCCC(O)C=C
InChI
1S/C7H14O/c1-3-5-6-7(8)4-2/h4,7-8H,2-3,5-6H2,1H3
InChI key
PZKFYTOLVRCMOA-UHFFFAOYSA-N
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General description
1-Hepten-3-ol (HEPT) is an allylic alcohol. It is one of the volatile compounds found in mentha citrate, flowers of Hyacinthus orientalis L. and green table olive fruits. It is reported to be a potent odor stimulus present in the human volatile emanations. 1-Hepten-3-ol is reported to elicit behavioral responses in Anopheles gambiae. Its mass spectra has been analyzed.
Application
1-Hepten-3-ol (HEPT) may be used in the synthesis of 1,1,1-trichloro-4-octanone.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Flam. Liq. 3
Storage Class Code
3 - Flammable liquids
WGK
WGK 3
Flash Point(F)
128.8 °F - closed cup
Flash Point(C)
53.8 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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A Palladium Catalyzed Conversion of Halohydrins to Ketones.
Jiro T, et al.
Tetrahedron Letters, 23(30), 3085-3088 (1982)
Yu Tong Qiu et al.
Chemical senses, 31(9), 845-863 (2006-09-12)
Olfactory receptor neurons (ORNs) in the antenna of insects serve to encode odors in action potential activity conducted to the olfactory lobe of the deuterocerebrum. We performed an analysis of the electrophysiological responses of olfactory neurons in the antennae of
The formation of [CH3CH2C(=OH)CH2]+. from 1-hepten-3-ol.
McAdoo DJ and Hudson CE.
Org. Mass Spectrom., 16(7), 294-296 (1981)
Mass spectrometry in structural and stereochemical problems. CCXLI. Investigation of the electron impact induced fragmentations of 1-hepten-3-ol by ion cyclotron resonance.
Journal of the American Chemical Society 96.11 (1974): 3477-3481.
Journal of the American Chemical Society 96.11 (1974): 3477-3481.
Grant B and Djerassi C.
Journal of the American Chemical Society, 96(11), 3477-3481 (1974)
Free and glycosidically bound volatiles of Mentha citrata ehrh.
Mastelic J, et al.
Croatica Chemica Acta. Arhiv Za Kemiju, 73(3), 781-794 (2000)
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