pyranocoumarin

Modify Date: 2024-01-02 15:49:55

pyranocoumarin Structure
pyranocoumarin structure
Common Name pyranocoumarin
CAS Number 518-20-7 Molecular Weight 322.35500
Density 1.27g/cm3 Boiling Point 488.6ºC at 760 mmHg
Molecular Formula C20H18O4 Melting Point 166°
MSDS Chinese USA Flash Point 216.2ºC
Symbol GHS06
GHS06
Signal Word Danger

 Use of pyranocoumarin


Cyclocumarol is an anticoagulant similar to but less potent than warfarin. This product may cause hemorrhaging if used indiscriminately.

 Names

Name 2-methoxy-2-methyl-4-phenyl-3,4-dihydropyrano[3,2-c]chromen-5-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.27g/cm3
Boiling Point 488.6ºC at 760 mmHg
Melting Point 166°
Molecular Formula C20H18O4
Molecular Weight 322.35500
Flash Point 216.2ºC
Exact Mass 322.12100
PSA 48.67000
LogP 4.07000
Index of Refraction 1.624

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UQ0335200
CHEMICAL NAME :
2H,5H-Pyrano(3,2-c)(1)benzopyran-5-one, 3,4-dihydro-2-methoxy-2-methyl-4-phenyl-
CAS REGISTRY NUMBER :
518-20-7
LAST UPDATED :
199409
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C20-H18-O4
MOLECULAR WEIGHT :
322.38

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
4 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85ARAE "Agricultural Chemicals," Thomson, W.T., 4 vols., Fresno, CA, Thomson Publications, 1976/77 revision Volume(issue)/page/year: 3,142,1986
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
21 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85JFAN "Agrochemicals Handbook," with updates, Hartley, D., and H. Kidd, eds., Nottingham, Royal Soc. of Chemistry, 1983-86 Volume(issue)/page/year: A355,1983
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1600 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
SMWOAS Schweizerische Medizinische Wochenschrift. (Schwabe & Co., Steintorst 13, 4010 Basel, Switzerland) V.50- 1920- Volume(issue)/page/year: 83,471,1953
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
SMWOAS Schweizerische Medizinische Wochenschrift. (Schwabe & Co., Steintorst 13, 4010 Basel, Switzerland) V.50- 1920- Volume(issue)/page/year: 83,471,1953

 Safety Information

Symbol GHS06
GHS06
Signal Word Danger
Hazard Statements H310
Precautionary Statements P262-P280-P302 + P352 + P310-P361 + P364
Personal Protective Equipment Eyeshields;Faceshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges
Hazard Codes T+
Risk Phrases 27
Safety Phrases 28-36/37-45
RIDADR UN 2811
RTECS UQ0335200
Packaging Group III
Hazard Class 6.1(b)
HS Code 2932999099

 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%

 Articles3

More Articles
The preferred solution conformation of warfarin at the active site of cytochrome P-450 based on the CD spectra in octanol/water model system.

J. Med. Chem. 27(8) , 1092-5, (1984)

An octanol/water model system and circular dichroism (CD) spectroscopy have been used to study the solution conformation of warfarin in aqueous and lipid environments. Upon partitioning of (S)-warfari...

Structural forms of phenprocoumon and warfarin that are metabolized at the active site of CYP2C9.

Arch. Biochem. Biophys. 372(1) , 16-28, (1999)

Possible reasons for the observed differences in metabolic behavior and drug interaction liability between the structurally similar oral anticoagulants warfarin and phenprocoumon were explored. Incuba...

Inhibitory effect of coumarins on HIV-1 replication and cell-mediated or cell-free viral transmission.

Acta Virol. 37(4) , 241-50, (1993)

A single dose of coumarin derivatives, warfarin, 4-hydroxycoumarin and umbelliferone, added at the time of inoculation either by free virus or by contact with U1 monocytes exhibited a dose-dependent i...

 Synonyms

Pyranocumarin [German]
Cumopyran
Compound 63 link
CYCLOCUMAROL
Methanopyranorin
Cyclocoumarol
Anticoagulans 63
BL 5
Cumopyrin
Pyranocoumarin
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