Tìm theo
Pyruvoyl Group
Thuốc Gốc
Small Molecule
CTHH: C3H4O2
PTK: 72.0627
An organic compound used often as a reagent in organic synthesis, as a flavoring agent, and in tanning. It has been demonstrated as an intermediate in the metabolism of acetone and its derivatives in isolated cell preparations, in various culture media, and in vivo in certain animals. [PubChem]
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C3H4O2
Phân tử khối
72.0627
Monoisotopic mass
72.021129372
InChI
InChI=1S/C3H4O2/c1-3(5)2-4/h2H,1H3
InChI Key
InChIKey=AIJULSRZWUXGPQ-UHFFFAOYSA-N
IUPAC Name
2-oxopropanal
Traditional IUPAC Name
pyruvoyl group
SMILES
CC(=O)C=O
Độ hòa tan
1.80e+02 g/l
logP
0.2
logS
0.4
pKa (strongest acidic)
16.38
pKa (Strongest Basic)
-8
PSA
34.14 Å2
Refractivity
17.05 m3·mol-1
Polarizability
6.42 Å3
Rotatable Bond Count
1
H Bond Acceptor Count
2
H Bond Donor Count
0
Physiological Charge
0
Number of Rings
0
Bioavailability
1
Rule of Five
true
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB03587
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=880
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46509036
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