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Butane-1,2,4-Triol
[CAS 6810-31-7]

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Achemica Switzerland
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Identification
Name Butane-1,2,4-Triol
Synonyms Ncgc00166117-01; Ncgc00166053-01; Nsc 60197
Molecular Structure CAS#: 6810-31-7, Butane-1,2,4-Triol
Molecular Formula C4H10O3
Molecular Weight 106.12
CAS Registry Number 6810-31-7
SMILES C(C(CO)O)CO
InChI 1S/C4H10O3/c5-2-1-4(7)3-6/h4-7H,1-3H2
InChIKey ARXKVVRQIIOZGF-UHFFFAOYSA-N
Properties
Density 1.2±0.1g/cm3 (Cal.)
1.182 (Expl.)
Melting point -20°C (Expl.)
Boiling point 303.906°C at 760 mmHg (Cal.)
190-191°C (Expl.)
Flash point 188°C (Expl.)
153.9±16.4°C (Cal.)
Refractive index 1.475 (Expl.)
Safety Data
Safety Description CAUTION: May irritate eyes, skin, and respiratory tract
References
(1) Aritomo Yamaguchi, Norihito Hiyoshi, Osamu Sato, Kyoko K. Bando and Masayuki Shirai. Enhancement of cyclic ether formation from polyalcohol compounds in high temperature liquid water by high pressure carbon dioxide, Green Chem., 2009, 11, 48.
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