Structure

L-Quebrachitol

CAS
642-38-6
Catalog Number
ACM642386
Category
Other Products
Molecular Weight
194.18
Molecular Formula
C7H14O6

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Specification

Synonyms
(-)-Quebrachitol
IUPAC Name
(1R,2S,4S,5R)-6-methoxycyclohexane-1,2,3,4,5-pentol
Canonical SMILES
COC1[C@@H]([C@H](C([C@@H]([C@H]1O)O)O)O)O
InChI
InChI=1S/C7H14O6/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h2-12H,1H3/t2?,3-,4-,5+,6+,7?/m0/s1
InChI Key
DSCFFEYYQKSRSV-MBXCVVGISA-N
Boiling Point
250.62 °C
Melting Point
190-198 °C
Flash Point
145.6ºC
Density
1.56±0.1 g/ml
Appearance
Solid
Exact Mass
194.07900
H-Bond Acceptor
6
H-Bond Donor
5
pKa
12.98±0.70
Safety Description
S24/25
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