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115-76-4

115-76-4 structure
115-76-4 structure
  • Name: Prenderol
  • Chemical Name: 2,2-Diethyl-1,3-propanediol
  • CAS Number: 115-76-4
  • Molecular Formula: C7H16O2
  • Molecular Weight: 132.20100
  • Catalog: Chemical reagent Organic reagent Fatty alcohol
  • Create Date: 2018-09-10 17:23:18
  • Modify Date: 2025-08-25 08:47:03
  • Prenderol is a potent central-nervous-system depressant. Prenderol has anticonvulsant activity[1].
Name 2,2-Diethyl-1,3-propanediol
Synonyms 2,2-DIETHYL-1,3-PROPANEDIOL
2,2-diethylpropane-1,3-diol
2,2-Dihydroxy-2,2-diethylpropane
3,3-Bis(hydroxymethyl)pentane
EINECS 204-103-3
2,2-Diethyl-2,2-dihydroxypropane
MFCD00004695
Description Prenderol is a potent central-nervous-system depressant. Prenderol has anticonvulsant activity[1].
Related Catalog
References

[1]. Slater, I. H., et al. 2,2-Diethyl-1,4-butanediol, a convulsant homolog of the depressant, 2,2-diethyl-1,3-propanediol.
Density 0.95g/mLat 25°C (lit.)
Boiling Point 160 °C (50 mmHg)
Melting Point 59-61 °C(lit.)
Molecular Formula C7H16O2
Molecular Weight 132.20100
Flash Point 102 °C
Exact Mass 132.11500
PSA 40.46000
LogP 0.77740
Vapour Pressure 0.00657mmHg at 25°C
Index of Refraction 1.451

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TY5250000
CHEMICAL NAME :
1,3-Propanediol, 2,2-diethyl-
CAS REGISTRY NUMBER :
115-76-4
BEILSTEIN REFERENCE NO. :
1697711
LAST UPDATED :
199806
DATA ITEMS CITED :
8
MOLECULAR FORMULA :
C7-H16-O2
MOLECULAR WEIGHT :
132.23
WISWESSER LINE NOTATION :
Q1X2&2&1Q

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Open irritation test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
UCDS** Union Carbide Data Sheet. (Union Carbide Corp., 39 Old Ridgebury Rd., Danbury, CT 06817) Volume(issue)/page/year: 2/21/1958 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
850 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
UCDS** Union Carbide Data Sheet. (Union Carbide Corp., 39 Old Ridgebury Rd., Danbury, CT 06817) Volume(issue)/page/year: 2/21/1958
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
700 mg/kg
TOXIC EFFECTS :
Behavioral - altered sleep time (including change in righting reflex) Behavioral - excitement Nutritional and Gross Metabolic - body temperature decrease
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 100,27,1950
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
635 mg/kg
TOXIC EFFECTS :
Behavioral - altered sleep time (including change in righting reflex) Behavioral - excitement Nutritional and Gross Metabolic - body temperature decrease
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 100,27,1950
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1550 mg/kg
TOXIC EFFECTS :
Behavioral - altered sleep time (including change in righting reflex) Behavioral - excitement Nutritional and Gross Metabolic - body temperature decrease
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 100,27,1950
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1220 mg/kg
TOXIC EFFECTS :
Behavioral - altered sleep time (including change in righting reflex) Behavioral - excitement Nutritional and Gross Metabolic - body temperature decrease
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 100,27,1950
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1170 mg/kg
TOXIC EFFECTS :
Behavioral - altered sleep time (including change in righting reflex) Behavioral - excitement Nutritional and Gross Metabolic - body temperature decrease
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 100,27,1950
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
4240 uL/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AMIHBC AMA Archives of Industrial Hygiene and Occupational Medicine. (Chicago, IL) V.2-10, 1950-54. For publisher information, see AEHLAU. Volume(issue)/page/year: 10,61,1954
Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H302-H319
Precautionary Statements P301 + P312 + P330-P305 + P351 + P338
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes Xn:Harmful;
Risk Phrases R22;R36
Safety Phrases S26
RIDADR NONH for all modes of transport
WGK Germany 2
RTECS TY5250000
HS Code 2905399090
77-25-8 structure

77-25-8

~74%

115-76-4 structure

115-76-4

Literature: Bulletin of the Chemical Society of Japan, , vol. 77, # 6 p. 1173 - 1180
50-00-0 structure

50-00-0

~%

115-76-4 structure

115-76-4

Literature: Journal of the American Chemical Society, , vol. 70, p. 1982
57-44-3 structure

57-44-3

~%

115-76-4 structure

115-76-4

Literature: Journal of Organic Chemistry, , vol. 33, # 1 p. 206 - 212
50-00-0 structure

50-00-0

97-96-1 structure

97-96-1

~%

115-76-4 structure

115-76-4

Literature: Journal of the American Chemical Society, , vol. 70, p. 1982 Journal of the American Chemical Society, , vol. 70, p. 948
HS Code 2905399090
Summary 2905399090 other diols。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:5.5%。general tariff:30.0%
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