Formamidine acetate
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Formamidine acetate
structure -
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CAS No:
3473-63-0
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Formula:
C2H4O2.CH4N2
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Chemical Name:
Formamidine acetate
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Synonyms:
Methanimidamide,acetate (1:1);Formamidine,monoacetate;Methanimidamide,monoacetate;Formamidine acetate;Formamidinium acetate;Methanimidamide acetate;Formamidine acetate (1:1);NSC 96608;Formimidamide acetate;Acetic acid methanimidamide;40730-94-7;87667-19-4;146797-05-9
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CAS No:
Formamidine acetate Basic Attributes
104.11
104.058578
3563488
222-442-5
96608
DTXSID3063047
29252000
Characteristics
87.2
Clear colorless to light yellow Liquid
1.124
162-164 °C
40ºC
H2O: 832 g/L (21 ºC)
-20°C
LD50 orally in Rabbit: 2510 mg/kg LD50 dermal Rat > 2000 mg/kg
Safety Information
NONH for all modes of transport
2
43-36/37/38
36/37-37/39-26-36/37/39-27
Xi
P280
H317
|Warning|H315 (13.59%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 103 companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Formamidine acetate Use and Manufacturing
It is derived from triethyl orthoformate and glacial acetic acid through ammonia condensation. Add triethyl orthoformate to glacial acetic acid and heat, pass ammonia to react for 1.5h, and precipitate white crystals, then continue to pass ammonia for half an hour. The reactant is firstly distilled at atmospheric pressure, and then the alcohol is evaporated by vacuum distillation. Cool to 25°C, wash with absolute ethanol, filter, and dry to obtain formamidine acetate.
Methylacetate acetate is mainly used for the synthesis of a class of compounds with biological activity such as the anti-tumor drug 4-hydroxy-5-fluoropyrimidine, etc., as well as the synthesis of cyclohexanone peptide antifungal drugs, the synthesis of trichloropyrimidine, etc.
Methanimidamide, acetate (1:1): ACTIVE
Computed Properties
Molecular Weight:104.11
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Exact Mass:104.058577502
Monoisotopic Mass:104.058577502
Topological Polar Surface Area:87.2
Heavy Atom Count:7
Complexity:41.3
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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