CAS 100-79-8|Solketal

Introduction：Basic information about CAS 100-79-8|Solketal, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
MUTATION DATA
4. Safety Information
5. Customs
6. Articles17
7. Synonyms

Common Name	Solketal
CAS Number	100-79-8	Molecular Weight	132.158
Density	1.0±0.1 g/cm3	Boiling Point	188.5±0.0 °C at 760 mmHg
Molecular Formula	C₆H₁₂O₃	Melting Point	/
MSDS	ChineseUSA	Flash Point	80.0±0.0 °C
Symbol	GHS07	Signal Word	Warning

Names

Name	DL-1,2-Isopropylideneglycerol
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.0±0.1 g/cm3
Boiling Point	188.5±0.0 °C at 760 mmHg
Molecular Formula	C₆H₁₂O₃
Molecular Weight	132.158
Flash Point	80.0±0.0 °C
Exact Mass	132.078644
PSA	38.69000
LogP	0.06
Vapour Pressure	0.2±0.7 mmHg at 25°C
Index of Refraction	1.424
InChIKey	RNVYQYLELCKWAN-UHFFFAOYSA-N
SMILES	CC1(C)OCC(CO)O1
Storage condition	2-8°C
Water Solubility	miscible

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: JI0400000

CHEMICAL NAME :: 1,3-Dioxolane-4-methanol, 2,2-dimethyl-

CAS REGISTRY NUMBER :: 100-79-8

BEILSTEIN REFERENCE NO. :: 0104465

LAST UPDATED :: 199710

DATA ITEMS CITED :: 9

MOLECULAR FORMULA :: C6-H12-O3

MOLECULAR WEIGHT :: 132.18

WISWESSER LINE NOTATION :: T5O COTJ B1 B1 D1Q

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: Standard Draize test

ROUTE OF EXPOSURE :: Administration into the eye

SPECIES OBSERVED :: Rodent - rabbit

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 7 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 3 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 3740 ug/kg

TOXIC EFFECTS :: Cardiac - change in rate Vascular - BP elevation not characterized in autonomic section Vascular - BP lowering not characterized in autonomic section

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - rabbit

DOSE/DURATION :: 8530 ug/kg

TOXIC EFFECTS :: Cardiac - change in rate Vascular - BP elevation not characterized in autonomic section Vascular - BP lowering not characterized in autonomic section

MUTATION DATA

TEST SYSTEM :: Rodent - mouse

DOSE/DURATION :: 1500 mg/kg

REFERENCE :: TOLED5 Toxicology Letters. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1977- Volume(issue)/page/year: 21,349,1984

Safety Information

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H319
Precautionary Statements	P305 + P351 + P338
Personal Protective Equipment	Eyeshields;Gloves;half-mask respirator (US);multi-purpose combination respirator cartridge (US)
Hazard Codes	Xi: Irritant;
Risk Phrases	R36/37/38
Safety Phrases	S24/25
WGK Germany	2
RTECS	JI0400000
HS Code	29329970

Customs

HS Code	2932999099
Summary	2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Articles17

Identifying new lignin bioengineering targets: 1. Monolignol-substitute impacts on lignin formation and cell wall fermentability.

BMC Plant Biol. 10 , 114, (2010)

Recent discoveries highlighting the metabolic malleability of plant lignification indicate that lignin can be engineered to dramatically alter its composition and properties. Current plant biotechnolo...

In vitro toxicities of experimental jet fuel system ice-inhibiting agents.

Sci. Total Environ. 274(1-3) , 209-18, (2001)

One research emphasis within the Department of Defense has been to seek the replacement of operational compounds with alternatives that pose less potential risk to human and ecological systems. Altern...

Effects of glycerol acetonide on adrenergic neurotransmission in isolated rabbit heart.

Arzneimittelforschung 42(11) , 1288-91, (1992)

In the present investigation, the solvent glycerol acetonide (GA, CAS 100-79-8) was added (110 mg/min) to the Tyrode buffer perfusing an isolated rabbit heart preloaded with 14C-noradrenaline (NA). GA...

Synonyms

(±)-2,2-Dimethyl-4-hydroxymethyl-1,3-dioxolane

Solketal

(2,2-Dimethyl-1,3-dioxolan-4-yl)methanol

2,2-Dimethyl-4-(hydroxymethyl)-1,3-dioxacyclopentane

2,3-(Isopropylidenedioxy)propanol

(±)-2,2-Dimethyl-1,3-dioxolane-4-methanol

1,2-Isopropylidene-rac-glycerol

(RS)-Solketal

2,2-Dimethyl-4-hydroxymethyl-1,3-dioxolane

1,2-Isopropylideneglycerol

T5O COTJ B1 B1 D1Q

1,2-O-Isopropylideneglycerol

(±)-1,2-O-Isopropylideneglycerol

(±)-2,3-O-Isopropylideneglycerol

EINECS 202-888-7

2,3-O-Isopropylideneglycerol

DL-1,2-O-Isopropylidene glycerol

1,3-Dioxolane-4-methanol, 2,2-dimethyl-

α,β-Isopropylideneglycerol

Glycerol acetonide

2,3-Isopropylideneglycerol

MFCD00063238

2,2-Dimethyl-1,3-dioxolane-4-methanol

Isopropylidene glycerol

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