Introduction：Basic information about CAS 64091-90-3|4-(methylnitrosamino)-4-(3-pyridyl)butanal, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 4-(methylnitrosamino)-4-(3-pyridyl)butanal |
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| CAS Number | 64091-90-3 | Molecular Weight | 207.22900 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C10H13N3O2 | Melting Point | / |
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| MSDS | / | Flash Point | / |
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Names
| Name | N-methyl-N-(4-oxo-1-pyridin-3-ylbutyl)nitrous amide |
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Chemical & Physical Properties
| Molecular Formula | C10H13N3O2 |
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| Molecular Weight | 207.22900 |
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| Exact Mass | 207.10100 |
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| PSA | 62.63000 |
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| LogP | 1.71500 |
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| InChIKey | FRJHUNPWTKLYGL-UHFFFAOYSA-N |
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| SMILES | CN(N=O)C(CCC=O)c1cccnc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- EJ3465000
- CHEMICAL NAME :
- Butanal, 4-(N-methyl-N-nitrosamino)-4-(3-pyridyl)-
- CAS REGISTRY NUMBER :
- 64091-90-3
- BEILSTEIN REFERENCE NO. :
- 0396208
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 6
- MOLECULAR FORMULA :
- C10-H13-N3-O2
- MOLECULAR WEIGHT :
- 207.26
- WISWESSER LINE NOTATION :
- T6NJ CY2VHN1&NO
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 880 mg/kg/I
- TOXIC EFFECTS :
- Tumorigenic - neoplastic by RTECS criteria Lungs, Thorax, or Respiration - tumors
- TYPE OF TEST :
- TD - Toxic dose (other than lowest)
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 880 mg/kg/7W-I
- TOXIC EFFECTS :
- Tumorigenic - equivocal tumorigenic agent by RTECS criteria Lungs, Thorax, or Respiration - tumors
MUTATION DATA - TYPE OF TEST :
- Mutation in mammalian somatic cells
- TEST SYSTEM :
- Human Lymphocyte
- DOSE/DURATION :
- 120 mg/L
- REFERENCE :
- CRNGDP Carcinogenesis (London). (Oxford Univ. Press, Pinkhill House, Southfield Road, Eynsham, Oxford OX8 1JJ, UK) V.1- 1980- Volume(issue)/page/year: 12,1197,1991 *** REVIEWS *** IARC Cancer Review:Animal Inadequate Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 37,205,1985 IARC Cancer Review:Human No Adequate Data IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 37,205,1985 IARC Cancer Review:Group 3 IMSUDL IARC Monographs, Supplement. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) No.1- 1979- Volume(issue)/page/year: 7,56,1987
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