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Merck
CN

51930

Sigma-Aldrich

1-Hepten-3-ol

purum, ≥97.0% (GC)

Synonym(s):

Butyl vinyl carbinol

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About This Item

Linear Formula:
CH3(CH2)3CH(OH)CH=CH2
CAS Number:
4938-52-7
Molecular Weight:
114.19
Beilstein:
1720340
EC Number:
225-579-9
MDL number:
MFCD00021940
UNSPSC Code:
12352100
PubChem Substance ID:
329757765

Key Documents

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grade

purum

Assay

≥97.0% (GC)

refractive index

n20/D 1.433 (lit.)
n20/D 1.433

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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Pictograms

Flame
GHS02

Signal Word

Warning

Hazard Statements

H226

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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Pingxi Xu et al.
Proceedings of the National Academy of Sciences of the United States of America, 111(46), 16592-16597 (2014-10-29)
Insect repellents are important prophylactic tools for travelers and populations living in endemic areas of malaria, dengue, encephalitis, and other vector-borne diseases. DEET (N,N-diethyl-3-methylbenzamide) is a 6-decade-old synthetic repellent, which is still considered the gold standard of mosquito repellents. Mosquitoes

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