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3,3-Dimethyl-2-Butanol
[CAS# 464-07-3]

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Identification
Name 3,3-Dimethyl-2-Butanol
Synonyms 3,3-Dimethylbutane-2-Ol; Nsc939; 2-Butanol, 3,3-Dimethyl-, (S)-
Molecular Structure CAS#: 464-07-3, 3,3-Dimethyl-2-Butanol
Molecular Formula C6H14O
Molecular Weight 102.18
CAS Registry Number 464-07-3
EINECS 207-347-9
SMILES CC(C(C)O)(C)C
InChI 1S/C6H14O/c1-5(7)6(2,3)4/h5,7H,1-4H3
InChIKey DFOXKPDFWGNLJU-UHFFFAOYSA-N
Properties
Density 0.812 (Expl.)
0.8±0.1g/cm3 (Cal.)
Melting point 5.3°C (Expl.)
Boiling point 117.8±8.0°C at 760 mmHg (Cal.)
119-121°C (Expl.)
Flash point 28°C (Expl.)
28.889°C (Cal.)
Refractive index 1.415 (Expl.)
Safety Data
Safety Code S7;S26;S33;S37;S43;S60  Details
Risk Code R10;R36/37/38  Details
Hazard Symbol symbol  X  Details
Transport Information UN1987
Safety Description DANGER: FLAMMABLE, irritates skin and eyes
SDS Available
References
(1) M. R. V. S. Murty, N. Prasada Raju, S. Prabhakar and M. Vairamani. Chemical ionization mass spectral analysis of pinacolyl alcohol and development of derivatization method using p-tolyl isocyanate, Anal. Methods, 2010, 2, 1599.
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