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| CAS No.: | 16568-02-8 |
|---|---|
| Name: | gyromitrin |
| Article Data: | 3 |
| Molecular Structure: | |
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| Formula: | C4H8 N2 O |
| Molecular Weight: | 100.12 |
| Synonyms: | Formicacid, ethylidenemethylhydrazide (8CI);Hydrazinecarboxaldehyde,ethylidenemethyl- (9CI);Acetaldehyde N-formyl-N-methylhydrazone;Acetaldehydemethylformylhydrazone;Acetaldehyde-N-methyl-N-formylhydrazone;Ethylidenegyromitrin;Gyromitrin; |
| Density: | 0.93g/cm3 |
| Melting Point: | 19.5oC (VACUUM) |
| Boiling Point: | 135.8°Cat760mmHg |
| Flash Point: | 36°C |
| Safety: | Poison via ingestion and possibly other routes. Questionable carcinogen with experimental carcinogenic and tumorigenic data. When heated to decomposition it emits toxic fumes of NOx. |
| PSA: | 32.67000 |
| LogP: | 0.71620 |
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Chemistry
Product Name: Gyromitrin (CAS NO.16568-02-8)
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Molecular Formula: C4H8N2O
Molecular Weight:100.14g/mol
Mol File: 16568-02-8.mol
Boiling point: 135.8 °C at 760 mmHg
Flash Point: 36 °C
Density: 0.93 g/cm3
Surface Tension: 30.8 dyne/cm
Enthalpy of Vaporization: 37.32 kJ/mol
Vapour Pressure: 7.59 mmHg at 25°C
XLogP3-AA: -0.3
H-Bond Donor: 0
H-Bond Acceptor: 2
Rotatable Bond Count: 1
Topological Polar Surface Area: 32.7
Heavy Atom Count: 7
Complexity: 79.8
Defined Bond StereoCenter Count: 1
Covalently-Bonded Unit Count: 1
Toxicity Data With Reference
| 1. | unk-chd LDLo:10 mg/kg | MGLHAE Mitteilungen Aus Dem Gebiete Der Lebensmitteluntersuchung und Hygiene. 65 (1974),453. | ||
| 2. | unk-hmn LDLo:20 mg/kg | MGLHAE Mitteilungen Aus Dem Gebiete Der Lebensmitteluntersuchung und Hygiene. 65 (1974),453. | ||
| 3. | orl-rat LD50:320 mg/kg | FCTXAV Food and Cosmetics Toxicology. 15 (1977),575. | ||
| 4. | orl-mus LD50:344 mg/kg | MUREAV Mutation Research. 54 (1978),167. | ||
| 5. | orl-rbt LD50:50 mg/kg | NATWAY Naturwissenschaften. 62 (1975),395. |
Consensus Reports
IARC Cancer Review: Group 3 IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 7 (1987),p. 56.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) ; Animal Limited Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 7 (1987),p. 391.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) . EPA Genetic Toxicology Program.
Safety Profile
Poison via ingestion and possibly other routes. Questionable carcinogen with experimental carcinogenic and tumorigenic data. When heated to decomposition it emits toxic fumes of NOx.
Specification
Gyromitrin ,its CAS NO. is 16568-02-8,the synonyms is Acetaldehyde-n-methyl-n-formylhydrazone ; Formicacid,ethylidenemethylhydrazide ; Methylformylhydrazone ; Ethylenegyromitrin ; Acetaldehydemethylformylhydrazone ; 2-Ethylidene-1-methyl-1-hydrazinecarbaldehyde ; Ethylidene gyromitrin .