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4988-64-1

Basic Information
CAS No.: 4988-64-1
Name: 6-MERCAPTOPURINE RIBOSIDE
Article Data: 3
Molecular Structure:
Molecular Structure of 4988-64-1 (6-MERCAPTOPURINE RIBOSIDE)
Formula: C10H12 N4 O4 S
Molecular Weight: 284.296
Synonyms: 9H-Purine-6(1H)-thione,9-ribofuranosyl- (8CI)
Density: 1.4599 (rough estimate)
Melting Point: 220-223oC(lit.)
Boiling Point: 714.7±70.0 °C(Predicted)
Hazard Symbols: Xn
Risk Codes: R22
Safety: Poison by an unspecified route. Moderately toxic by ingestion, subcutaneous, and intraperitoneal routes. An experimental teratogen. Human mutation data reported. When heated to decomposition it emits very toxic fumes of SOx and NOx. See also MERCAPTANS.
PSA: 152.32000
LogP: -1.27350
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Chemistry

Product Name: Mercaptopurine ribonucleoside (CAS NO.4988-64-1)


Molecular Formula: C10H12N4O4S
Molecular Weight: 284.29g/mol
Mol File: 4988-64-1.mol
Einecs: 209-371-5
Melting Point: 220-223 °C(lit.)
Boiling point: 714.7 °C at 760 mmHg
Flash Point: 386 °C
Density: 2.02 g/cm3
Surface Tension: 92.5 dyne/cm
Enthalpy of Vaporization: 109.67 kJ/mol
Vapour Pressure: 1.95E-21 mmHg at 25°C
XLogP3: -0.6
H-Bond Donor: 4
H-Bond Acceptor: 6

Toxicity Data With Reference

1.    

sce-hmn:lym 100 nmol/L

    CTRRDO    Cancer Treatment Reports. 69 (1985),505.
2.    

orl-rat LD50:900 mg/kg

    NIIRDN    “Drugs in Japan. Ethical Drugs, 6th Edition 1982“ Edited by Japan Pharmaceutical Information Center. 6 (1982),853.
3.    

ipr-rat LD50:1240 mg/kg

    NIIRDN    “Drugs in Japan. Ethical Drugs, 6th Edition 1982“ Edited by Japan Pharmaceutical Information Center. 6 (1982),853.
4.    

scu-rat LD50:1180 mg/kg

    NIIRDN    “Drugs in Japan. Ethical Drugs, 6th Edition 1982“ Edited by Japan Pharmaceutical Information Center. 6 (1982),853.
5.    

orl-mus LD50:5 g/kg

    OYYAA2    Oyo Yakuri. Pharmacometrics. 6 (1972),1275.
6.    

ipr-mus LD50:490 mg/kg

    CPBTAL    Chemical and Pharmaceutical Bulletin. 16 (1968),2080.
7.    

scu-mus LD50:1840 mg/kg

    NIIRDN    “Drugs in Japan. Ethical Drugs, 6th Edition 1982“ Edited by Japan Pharmaceutical Information Center. 6 (1982),853.
8.    

unr-mus LD10:250 mg/kg

    PMDCAY    Progress in Medical Chemistry. 7 (1970),69.

Safety Profile

Safety Information of Mercaptopurine ribonucleoside (CAS NO.4988-64-1):
Hazard Codes: Xn
Risk Statements: 22 
22:  Harmful if swallowed
Safety Statements: 22-24/25
22:  Do not breathe dust
24:  Avoid contact with skin 
25:  Avoid contact with eyes

Specification

 Mercaptopurine ribonucleoside ,its CAS NO. is 4988-64-1,the synonyms is  9-[Beta-d-ribofuranosyl]-6-thiopurine ; 6-Thio-9-beta-d-ribofuranoside ; 6-Thioinosine ; 6-Purinethiol riboside ; 6-Mercaptopurine-9-beta-d-ribofuranoside ; 6-Mercaptopurine-9-d-riboside ; 6-Mercaptopurine ribonucleoside ; 6-Mercaptopurine riboside .