Synonym: 1,1-Dimethyl-1,3-propanediol; 1,3-Dihydroxy-3-methylbutane; 2-Methyl-2,4-butanediol; 3,3-Dimethyl-1,3-propanediol; 3-Hydroxy-3-methylbutan-1-ol; 3-Hydroxy-3-methylbutanol; 3-Methyl-1,3-butanediol; 3-Methyl-3-hydroxy-1-butyl alcohol; Isoprene glycol
CAS Number: 2568-33-4
Empirical Formula (Hill Notation): C5H12O2
Molecular Weight: 104.15
MDL Number: MFCD00059655
Linear Formula: (CH3)2C(OH)CH2CH2OH
Product Type: Chemical
assay |
≥97.0% (GC) |
bp |
203-205 °C (lit.) |
density |
0.976 g/mL at 20 °C (lit.) |
impurities |
≤1% water |
InChI |
1S/C5H12O2/c1-5(2,7)3-4-6/h6-7H,3-4H2,1-2H3 |
InChI key |
XPFCZYUVICHKDS-UHFFFAOYSA-N |
Quality Level |
200 |
refractive index |
n20/D 1.442 |
SMILES string |
CC(C)(O)CCO |
Packaging: |
250 mL in glass bottle |
RIDADR |
NONH for all modes of transport |
WGK Germany |
WGK 3 |
Flash Point(F) |
221.0 °F - closed cup |
Flash Point(C) |
105 °C - closed cup |
Purity |
≥97.0% (GC) |
bp |
203-205 °C (lit.) |
Density |
0.976 g/mL at 20 °C (lit.) |
Refractive Index |
n20/D 1.442 |
UNSPSC |
12352100 |