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14459-29-1

Basic Information
CAS No.: 14459-29-1
Name: HEMATOPORPHYRIN
Article Data: 12
Molecular Structure:
Molecular Structure of 14459-29-1 (HEMATOPORPHYRIN)
Formula: C34H38 N4 O6
Molecular Weight: 598.699
Synonyms: 2,18-Porphinedipropionicacid, 7,12-bis(1-hydroxyethyl)-3,8,13,17-tetramethyl- (8CI); Hematoporphyrin IX(6CI); 1,3,5,8-Tetramethyl-2,4-bis(a-hydroxyethyl)porphine-6,7-dipropionic acid;7,12-Bis(1-hydroxyethyl)-3,8,13,17-tetramethyl-2,18-porphinedipropionic acid;HP; Hematoporphyrin; HpIX; NSC 267084; NSC 59265; Photodyn
Density: 1.32g/cm3
Melting Point: 172.5°C
Boiling Point: 1192.7°Cat760mmHg
Flash Point: 675.1°C
Hazard Symbols: Toxic. Reported to be preferentially absorbed by cancerous tissues, making them fluoresce under UV light.
Safety: Poison by intravenous route. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx.
PSA: 171.36000
LogP: 2.64570
Synthetic route
73-03-0

cordycepin

14459-29-1

hematoporphyrin

C44H48ClN9O7

Conditions
ConditionsYield
Stage #1: hematoporphyrin With thionyl chloride
Stage #2: cordycepin
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    21H,23H-Porphine-2,18-dipropanoicacid, 7,12-bis(1-hydroxyethyl)-3,8,13,17-tetramethyl-

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    HEMATOPORPHYRIN

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    Haematoporphyrin

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    Hematoporphyrin

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Chemistry

IUPAC Name: 3-[18-(2-Carboxyethyl)-7,12-bis(1-hydroxyethyl)-3,8,13,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoic acid
Synonyms: 1,3,5,8-Tetramethyl-2,4-bis(alpha-hydroxyethyl)prophine-6,7-dipropionicacid ; 21H,23H-Porphine-2,18-dipropanoicacid,7,12-bis(1-hydroxyethyl)-3,8,13,17-te ; 7,12-Bis(1-hydroxyethyl)-3,8,13,17-tetramethyl-18-porphinedipropionicacid ; Hematoporphyrinix ;HP ; 8,13-Bis(1-hydroxyethyl)-3,7,12,17-tetramethyl-21H,23H-porphine-2,18-dipropionic acid ; Haematoporphyrin ; Hematoporphyrin
CAS NO: 14459-29-1
Molecular Formula: C34H38N4O6
Molecular Weight: 598.69
Molecular Structure:
EINECS: 238-450-7
Merck : 13,4653
Mol File: 14459-29-1.mol
Index of Refraction: 1.642
Surface Tension: 66.1 dyne/cm
Density: 1.328 g/cm3
Flash Point: 667.3 °C
Enthalpy of Vaporization: 182.92 kJ/mol
Boiling Point: 1179.7 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C
Storage temp: 2-8°C
Appearance: Photodyn (CAS NO.14459-29-1) is red purple crystal.
Solubility: Photodyn (CAS NO.14459-29-1) is soluble in ethanol, slightly soluble in ether and chloroform, insoluble in water.

Uses

 Photodyn (CAS NO.14459-29-1) is used in biochemical research and clinical treatment for cancer.

Production

Hemin (Hemin) in glacial acetic acid with treatment by hydrobromide ,then Photodyn (CAS NO.14459-29-1) is obtained.

Toxicity Data With Reference

1.    

dnd-nml 100 µmol/L

    CNREA8    Cancer Research. 41 (1981),3543.
2.    

dni-mus:leu 1 mg/L

    TUMOAB    Tumori. 67 (1981),183.
3.    

ivn-mus LD50:307 mg/kg

    NYKZAU    Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. 57 (1961),219.

Safety Profile

Poison by intravenous route. Mutation data reported. When heated to decomposition it emits toxic fumes of NOx.
Safety Statements 22-24/25
S22:Do not breathe dust. 
S24/25:Avoid contact with skin and eyes.
WGK Germany 3
RTECS TS5500000
F 8-10-21