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CAS Number: 2568-33-4
3-methylbutane-1,3-diol

Structure

3-methylbutane-1,3-diol
Name: 3-methylbutane-1,3-diol
Synonyms:
General Information
Product Number: 2568334

CAS Registry Number 2568-33-4
Name:
1,​3-​Butanediol, 3-​methyl-
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

 

Chemical Formula: C5H12O2
Exact Mass: 104.08
Molecular Weight: 104.15
m/z: 104.08 (100.0%), 105.09 (5.6%)

 

InChI:InChI=1S/C5H12O2/c1-5(2,7)3-4-6/h6-7H,3-4H2,1-2H3

InChI Key:XPFCZYUVICHKDS-UHFFFAOYSA-N

Canonical SMILES:CC(C)(CCO)O

Specification

98%

References
  1. (1) Kachalova, R. V.; Zhurnal Prikladnoi Khimii (Sankt-Peterburg, Russian Federation) 1968, V41(10), P2315-19 CAPLUS
  2. (5) Romanov, N. A.; Zhurnal Prikladnoi Khimii (Sankt-Peterburg, Russian Federation) 1983, V56(2), P333-7 CAPLUS
  3. (8) Farberov, M. I.; Zhurnal Obshchei Khimii 1957, V27, P2806-17 CAPLUS
  4. (10) Lebedeva, A. I.; Zhurnal Obshchei Khimii 1958, V28, P2782-6 CAPLUS
  5. (11) Esafov, V. I.; Zhurnal Obshchei Khimii 1962, V32, P2819-22 CAPLUS
  6. (15) Hellin, Michel; Bulletin de la Societe Chimique de France 1966, (6), P1890-8 CAPLUS
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