InChI: | InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9) |
Specification: |
The Glyphosate-ammonium is an organic compound with the formula C3H7NO5P.NH4. The IUPAC name of this chemical is azanium (carboxymethylamino)methyl-hydroxyphosphinate. With the CAS registry number 40465-66-5, it is also named as mmonium N-[(hydroxyphosphinato)methyl]glycinate.
Physical properties about Glyphosate-ammonium are: (1)ACD/LogD (pH 5.5): -6; (2)ACD/LogD (pH 7.4): -7; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 6; (8)#H bond donors: 4; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 74.88 Å2; (11)Flash Point: 235.5 °C; (12)Enthalpy of Vaporization: 79.71 kJ/mol; (13)Boiling Point: 465.8 °C at 760 mmHg; (14)Vapour Pressure: 5.74E-10 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)CNCP(=O)(O)O.N
(2)InChI: InChI=1/C3H8NO5P.H3N/c5-3(6)1-4-2-10(7,8)9;/h4H,1-2H2,(H,5,6)(H2,7,8,9);1H3
(3)InChIKey: PDYXIVPKOMYDOK-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C3H8NO5P.H3N/c5-3(6)1-4-2-10(7,8)9;/h4H,1-2H2,(H,5,6)(H2,7,8,9);1H3
(5)Std. InChIKey: PDYXIVPKOMYDOK-UHFFFAOYSA-N
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