Empirical Formula of Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1) (CAS NO.64092-22-4): C48H52MnN4O9
Molecular Weight: 883.8859
Flash Point: 231.9 °C
Enthalpy of Vaporization: 73.03 kJ/mol
Boiling Point: 436.4 °C at 760 mmHg
Vapour Pressure: 2.17E-08 mmHg at 25 °C
Structure of Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1) (CAS NO.64092-22-4):
IUPAC Name: 2-Benzoylbenzoate ; Manganese(2+) ; 3-(1-Methylpyrrolidin-2-yl)pyridine ; Trihydrate
Canonical SMILES: CN1CCCC1C2=CN=CC=C2.CN1CCCC1C2=CN=CC=C2.C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)[O-].C1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)[O-].O.O.O.[Mn+2]
InChI: InChI=1S/2C14H10O3.2C10H14N2.Mn.3H2O/c2*15-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)14(16)17;2*1-12-7-3-5-10(12)9-4-2-6-11-8-9;;;;/h2*1-9H,(H,16,17);2*2,4,6,8,10H,3,5,7H2,1H3;;3*1H2/q;;;;+2;;;/p-2
InChIKey: YZPHHQKKQFHFAL-UHFFFAOYSA-L
1. | orl-rat LDLo:300 mg/kg | NCNSA6 National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. 5 (1953),22. | ||
2. | ipr-rat LDLo:300 mg/kg | NCNSA6 National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. 5 (1953),22. |
A poison by ingestion and intraperitoneal routes. When heated to decomposition Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1) (CAS NO.64092-22-4) emits toxic vapors of NOx and Mn.
Nicotine, compd. with manganese(II) o-benzoyl benzoate, trihydrate (2:1) , its cas register number is 64092-22-4. It also can be called CID3048886 ; and Manganese, bis(2-benzoylbenzoato)bis(3-(1-methyl-2-pyrrolidinyl)pyridine)-, trihydrate .
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