CAS No.73873-87-7,Iloprost Suppliers

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Basic Information

Molecular Structure:
CAS No.:	73873-87-7
Name:	Iloprost

Formula:	C22H32O4
Molecular Weight:	360.49
Synonyms:	CILOPROST;6,9ALPHA-METHYLENE-11ALPHA,15S-DIHYDROXY-16-METHYL-PROSTA-5E,13E-DIEN-18-YN-1-OIC ACID;
Density:	1.21g/cm3
Boiling Point:	539.2oC at 760 mmHg
Flash Point:	294oC
Appearance:	colorless oil
PSA:	77.76000
LogP:	3.54130

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Chemistry

Molecule structure of Iloprost (CAS NO.73873-87-7):

IUPAC Name: (5E)-5-[(3aS,5R,6aS)-5-Hydroxy-4-[(E,3S)-3-hydroxy-4-methyloct-1-en-6-ynyl]-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]pentanoic acid
Molecular Weight: 360.48708 g/mol
Molecular Formula: C₂₂H₃₂O₄
Density: 1.21 g/cm³
Boiling Point: 539.2 °C at 760 mmHg
Flash Point: 294 °C
Index of Refraction: 1.629
Molar Refractivity: 105.88 cm³
Molar Volume: 297.7 cm³
Surface Tension: 64.8 dyne/cm
Enthalpy of Vaporization: 93.9 kJ/mol
Vapour Pressure: 7.06E-14 mmHg at 25 °C
XLogP3-AA: 2.8
H-Bond Donor: 3
H-Bond Acceptor: 4
Rotatable Bond Count: 8
Exact Mass: 360.23006
MonoIsotopic Mass: 360.23006
Topological Polar Surface Area: 77.8
Heavy Atom Count: 26
Canonical SMILES: CC#CCC(C)C(C=CC1C(CC2C1CC(=CCCCC(=O)O)C2)O)O
Isomeric SMILES: CC#CCC(C)[C@@H](/C=C/C1[C@@H](C[C@H]2[C@@H]1C/C(=C/CCCC(=O)O)/C2)O)O
InChI: InChI=1S/C22H32O4/c1-3-4-7-15(2)20(23)11-10-18-19-13-16(8-5-6-9-22(25)26)12-17(19)14-21(18)24/h8,10-11,15,17-21,23-24H,5-7,9,12-14H2,1-2H3,(H,25,26)/b11-10+,16-8+/t15?,17-,18?,19-,20+,21+/m0/s1
InChIKey: HIFJCPQKFCZDDL-SGSAMSKHSA-N
Product Categories: Prostaglandins

Uses

Iloprost (CAS NO.73873-87-7) is a drug used to treat pulmonary arterial hypertension (PAH), scleroderma, Raynaud's phenomenon and ischaemia.

Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intravenous	201mg/kg (201mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY) LUNGS, THORAX, OR RESPIRATION: DYSPNEA	New Cardiovascular Drugs. Vol. 4, Pg. 209, 1986.
mouse	LD50	oral	> 100mg/kg (100mg/kg)		Drugs of the Future. Vol. 6, Pg. 676, 1981.
rat	LD50	intravenous	119mg/kg (119mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY) LUNGS, THORAX, OR RESPIRATION: DYSPNEA	New Cardiovascular Drugs. Vol. 4, Pg. 209, 1986.
rat	LD50	oral	> 100mg/kg (100mg/kg)		Drugs of the Future. Vol. 6, Pg. 676, 1981.

Specification

Iloprost (CAS NO.73873-87-7) is also named as (16R,S)-Methyl-18,18,19,19-tetradehydro-6a-carbaprostaglandin I(sub 2) ; (E)-(3aS,4R,5R,6aS)-Hexahydro-5-hydroxy-4-((E)-(3S,4RS)-3-hydroxy-4-methyl-1-octen-6-ynyl)-delta(sup 2(1H),delta)-pentalenevaleric acid ; (E)-5-(3aS,4R,5R,6aS)-5-Hydroxy-4((E)-(3S,4RS)-3-hydroxy-4-methyl-1-octen-6-inyl)perhydropentalen-2-yliden)valeriansaeure ; Ciloprost ; Iloprostum ; Iloprostum [Latin] ; UNII-JED5K35YGL ; Ventavis ; ZK 36374 .