(R)-Solketal

HCID 736056
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
14347-78-5
Standard SMILES
CC1(C)OC[C@@H](CO)O1
InChIKey
RNVYQYLELCKWAN-RXMQYKEDSA-N
Molecular formula
C6H12O3
Average molar mass
132.16 g/mol
Monoisotopic mass
132.07864424

Overview

See also: 1,3-Dioxolane-4-methanol, 2,2-dimethyl-, (4R)- (annotation moved to).

Names & identifiers

Preferred name
(R)-Solketal
IUPAC
[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
English name
(R)-(-)-2,2-Dimethyl-1,3-dioxolane-4-methanol
Molecular formula
C6H12O3
Molecular weight
132.16

Names & synonyms

(R)-(-)-2,2-Dimethyl-1,3-dioxolane-4-methanol(R)-SolketalDTXSID501317906RefChem:407449DTXCID701747701604-360-514347-78-5(R)-(2,2-dimethyl-1,3-dioxolan-4-yl)methanol[(4r)-2,2-dimethyl-1,3-dioxolan-4-yl]methanolD-Acetone glycerolMFCD00003213(r)-2,2-dimethyl-1,3-dioxolane-4-methanol
Show more names
(R)-(-)-SOLKETAL(R)-(-)-1,2-Isopropylideneglycerol(R)-2,2-DIMETHYL 4-HYDROXYMETHYL-1,3-DIOXOLANE(R)-(-)-2,2-Dimethyl-1,3-dioxolane-4-methanol, L-α,β-Isopropylideneglycerol2,3-Isopropylidene-sn-glycerol, L-α,β-Isopropylideneglycerol, L-2,3-O-isopropylidene-sn-glycerolR-Glycerolane-4-methanoLR-(-)-Sollketal
AKOS005257631(r)-(-)-1,2-o-isopropylideneglycerolD17051,3-Dioxolane-4-methanol, 2,2-dimethyl-, (R)-(R)-(-)-(2,2-dimethyl-1,3-dioxolan-4-yl)methanol((4R)-2,2-dimethyl-1,3-dioxolan-4-yl)methanolL-(-)-1,2-Isopropylideneglycerolr-glycerol acetonide

Database identifiers

CAS
14347-78-5
PubChem CID
736056
DTXSID
DTXSID501317906
EC Number
604-360-5
Nikkaji
J208.404J

Properties

Computed structural properties

XLogP
-0.2
Topological polar surface area
38.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
9

Physicochemical properties

alpha
-13.7 · -13.7 º (neat)
Boiling point
72 · 72-73 °C/8 mmHg (lit.)
Density
1.062 g/mL · 1.062 g/mL at 25 °C (lit.)
refractive index
20 · n20/D 1.434
Flash point
176 °F · 176 °F
storage temp.
2 · 2-8°C

Safety & regulation

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 60% (3 of 5) of all reports.

Warning

H227 (20%): Combustible liquid [Warning Flammable liquids]

P210, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 4 (20%)

Safety data

F
10
PPE
Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
wgk
3
rtecs
JI0400000
hs_code
29329990
Signal word
Warning

Chemistry & industry

Applications · 3 items

Uses(R)-(-)-2,2-Dimethyl-1,3-dioxolane-4-methanol is a MEK inhibitor with antitumor activity.

Uses(R)-(-)-2,2-Dimethyl-1,3-dioxolane-4-methanol may be used to prepare:(R)-2,2-Dimethyl-4-benzoxymethyl-1,3-dioxolane.((S)-(2,2-Dimethyl-1,3-dioxolan-4-yl)methyl 4-methylbenzenesulfonate)-1,3-dioxolane.(S)-Glyceraldehyde acetonide.Tetraoxaspiroundecanes, diglycerides, glyceryl phosphates, and spiropyrans.

UsesA MEK inhibitor

Upstream & downstream products

Suppliers100 total

北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海科利生物医药有限公司13816253073 · [email protected]

Related reactions

88 records
New reaction record

Compound notes

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