CAS 127-31-1|fludrocortisone

Introduction:Basic information about CAS 127-31-1|fludrocortisone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Namefludrocortisone
CAS Number127-31-1Molecular Weight380.450
Density1.3±0.1 g/cm3Boiling Point564.7±50.0 °C at 760 mmHg
Molecular FormulaC21H29FO5Melting Point208-212ºC
MSDS/Flash Point295.3±30.1 °C

Names

Namefludrocortisone
SynonymMore Synonyms

fludrocortisone BiologicalActivity

DescriptionFludrocortisone, a synthetic mineralocorticoid with anti-inflammatory activity.
Related CatalogSignaling Pathways >>Metabolic Enzyme/Protease >>Mineralocorticoid ReceptorResearch Areas >>Inflammation/Immunology
References

[1]. Jaal J, et al. Small Cell Lung Cancer Patient with Profound Hyponatremia and Acute Neurological Symptoms: An Effective Treatment with Fludrocortisone. Case Rep Oncol Med. 2015;2015:286029.

[2]. Mori T, et al. Improved efficiency of hypervolemic therapy with inhibition of natriuresis by fludrocortisone in patients with aneurysmal subarachnoid hemorrhage. Journal of Neurosurgery [1999, 91(6):947-952]

Chemical & Physical Properties

Density1.3±0.1 g/cm3
Boiling Point564.7±50.0 °C at 760 mmHg
Melting Point208-212ºC
Molecular FormulaC21H29FO5
Molecular Weight380.450
Flash Point295.3±30.1 °C
Exact Mass380.199890
PSA94.83000
LogP1.23
Vapour Pressure0.0±3.5 mmHg at 25°C
Index of Refraction1.584
InChIKeyAAXVEMMRQDVLJB-BULBTXNYSA-N
SMILESCC12CCC(=O)C=C1CCC1C3CCC(O)(C(=O)CO)C3(C)CC(O)C12F
Storage conditionRefrigerator

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TU5025000
CHEMICAL NAME :
Pregn-4-ene-3,20-dione, 9-fluoro-11-beta,17,21-trihydroxy-
CAS REGISTRY NUMBER :
127-31-1
BEILSTEIN REFERENCE NO. :
3014278
LAST UPDATED :
199710
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C21-H29-F-O5
MOLECULAR WEIGHT :
380.50
WISWESSER LINE NOTATION :
L E5 B666 OV MUTJ A1 BF CQ E1 FV1Q FQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
170 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CLDND* Compilation of LD50 Values of New Drugs. (J.R. MacDougal, Dept. of National Health and Welfare, Food and Drug Divisions, 35 John St., Ottawa, Ont., Canada) ** REPRODUCTIVE DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Parenteral
DOSE :
8750 ug/kg
SEX/DURATION :
female 7 day(s) pre-mating
TOXIC EFFECTS :
Reproductive - Maternal Effects - uterus, cervix, vagina
REFERENCE :
JEMEAV Journal of Experimental Medicine. (Rockefeller Univ. Press, 1230 York Ave., New York, NY 10021) V.1- 1896- Volume(issue)/page/year: 102,347,1955
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
100 mg/kg
SEX/DURATION :
female 6-15 day(s) after conception
TOXIC EFFECTS :
Reproductive - Specific Developmental Abnormalities - craniofacial (including nose and tongue)
REFERENCE :
28QFAD "Laboratory Animals in Drug Testing, Symposium of the 5th International Committee on Laboratory Animals, Hanover, 1972," Speigel, A. ed., Stuttgart, Fed. Rep. Ger., Gustav Fischer Verlag, 1973 Volume(issue)/page/year: -,85,1973
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
1 mg/kg
SEX/DURATION :
female 13-16 day(s) after conception
TOXIC EFFECTS :
Reproductive - Effects on Embryo or Fetus - fetal death
REFERENCE :
28QFAD "Laboratory Animals in Drug Testing, Symposium of the 5th International Committee on Laboratory Animals, Hanover, 1972," Speigel, A. ed., Stuttgart, Fed. Rep. Ger., Gustav Fischer Verlag, 1973 Volume(issue)/page/year: -,85,1973
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
2 mg/kg
SEX/DURATION :
female 13-16 day(s) after conception
TOXIC EFFECTS :
Reproductive - Specific Developmental Abnormalities - craniofacial (including nose and tongue)
REFERENCE :
28QFAD "Laboratory Animals in Drug Testing, Symposium of the 5th International Committee on Laboratory Animals, Hanover, 1972," Speigel, A. ed., Stuttgart, Fed. Rep. Ger., Gustav Fischer Verlag, 1973 Volume(issue)/page/year: -,85,1973

Safety Information

Hazard CodesXn
Risk Phrases63
Safety Phrases22-26-36
HS Code2937210000

Customs

HS Code2937210000

Synonyms

Fludrocortone
(11β)-9-Fluoro-11,17,21-trihydroxypregn-4-ene-3,20-dione
9a-Fluorocortisol
9α-Fluorocortisol
Alflorone
Fluorocortisone
9α-Fluoro-11β,17α,21-trihydroxy-4-pregnene-3,20-dione
9a-Fluorohydrocortisone
Fludrocortisona [INN-Spanish]
Pregn-4-ene-3,20-dione, 9-fluoro-11,17,21-trihydroxy-, (11β)-
MFCD00083333
9-α-Fluoro-17-hydroxycorticosterone
Fluohydrocortisone
(8S,9R,10S,11S,13S,14S,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Fluorocortisol
Florinef
9α-Fluoro-17-hydroxycorticosterone
9-Fluoro-11β,17,21-trihydroxypregn-4-ene-3,20-dione
Astonin-H
9α-Fludrocortisone
9a-Fluoro-17-hydroxycorticosterone
Fluohydrisone
(11b)-9-Fluoro-11,17,21-trihydroxypregn-4-ene-3,20-dione
9-α-Fludrocortisone
EINECS 204-833-2
Fludrone
9α-Fluorohydrocortisone
fludrocortisone
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