6-cyanopurine

Modify Date: 2024-01-02 18:23:56

6-cyanopurine Structure
6-cyanopurine structure
Common Name 6-cyanopurine
CAS Number 2036-13-7 Molecular Weight 145.12200
Density 1.56g/cm3 Boiling Point 529.5ºC at 760mmHg
Molecular Formula C6H3N5 Melting Point 186-189ºC(lit.)
MSDS USA Flash Point 161.9ºC
Symbol GHS07
GHS07
Signal Word Warning

 Names

Name 7H-purine-6-carbonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.56g/cm3
Boiling Point 529.5ºC at 760mmHg
Melting Point 186-189ºC(lit.)
Molecular Formula C6H3N5
Molecular Weight 145.12200
Flash Point 161.9ºC
Exact Mass 145.03900
PSA 78.25000
LogP 0.22458
Vapour Pressure 0.00496mmHg at 25°C
Index of Refraction 1.852

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UO7518000
CHEMICAL NAME :
Purine-6-carbonitrile
CAS REGISTRY NUMBER :
2036-13-7
LAST UPDATED :
198502
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C6-H3-N5
MOLECULAR WEIGHT :
145.14

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Parenteral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
80 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPMSAE Journal of Pharmaceutical Sciences. (American Pharmaceutical Assoc., 2215 Constitution Ave., NW, Washington, DC 20037) V.50- 1961- Volume(issue)/page/year: 71,618,1982

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H302-H312-H315-H319-H332-H335
Precautionary Statements P261-P280-P305 + P351 + P338
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes Xn: Harmful;
Risk Phrases R20/21/22
Safety Phrases 26-36
RIDADR NONH for all modes of transport
WGK Germany 3
RTECS UO7518000
HS Code 2933990090

 Synthetic Route

~95%

6-cyanopurine Structure

6-cyanopurine

CAS#:2036-13-7

Literature: Hocek, Michal; Holy, Antonin Collection of Czechoslovak Chemical Communications, 1995 , vol. 60, # 8 p. 1386 - 1389

~90%

6-cyanopurine Structure

6-cyanopurine

CAS#:2036-13-7

Literature: Warner-Lambert Company Patent: US4801698 A1, 1989 ;

~%

6-cyanopurine Structure

6-cyanopurine

CAS#:2036-13-7

Literature: Collection of Czechoslovak Chemical Communications, , vol. 60, # 8 p. 1386 - 1389

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Articles3

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Efficient conversion of 6-cyanopurines into 6-alkoxyformimidoylpurines.

Org. Biomol. Chem. 2(7) , 1019-24, (2004)

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Soluble aldehyde dehydrogenase and metabolism of aldehydes by soybean bacteroids.

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 Synonyms

Purine-6-carbonitrile
EINECS 218-005-3
6-Purinecarbonitrile
6-Cyano-purin
6-Cyanoadenine
6-Cyan-purin
MFCD00005569
6-Cyanopurine
Purine,6-cyano
1H-Purine-6-carbonitrile