Tìm theo
4-[Hydroxy-[Methyl-Phosphinoyl]]-3-Oxo-Butanoic Acid
Thuốc Gốc
Small Molecule
CTHH: C5H9O5P
PTK: 180.0957
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
Phân tử khối
180.0957
Monoisotopic mass
180.01875991
InChI
InChI=1S/C5H9O5P/c1-11(9,10)3-4(6)2-5(7)8/h2-3H2,1H3,(H,7,8)(H,9,10)
InChI Key
InChIKey=MZTALSPOBPYJPG-UHFFFAOYSA-N
IUPAC Name
4-[hydroxy(methyl)phosphoryl]-3-oxobutanoic acid
Traditional IUPAC Name
4-[hydroxy(methyl)phosphoryl]-3-oxobutanoic acid
SMILES
C[P@@](O)(=O)CC(=O)CC(O)=O
Độ hòa tan
2.99e+01 g/l
logP
-0.99
logS
-0.78
pKa (strongest acidic)
1.85
pKa (Strongest Basic)
-7.8
PSA
91.67 Å2
Refractivity
36.83 m3·mol-1
Polarizability
14.7 Å3
Rotatable Bond Count
4
H Bond Acceptor Count
5
H Bond Donor Count
2
Physiological Charge
-2
Number of Rings
0
Bioavailability
1
Rule of Five
true
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