Tìm theo
Methyl Methylsulfinylmethyl Sulfide
Thuốc Gốc
Small Molecule
CAS: 33577-16-1
CTHH: C3H8OS2
PTK: 124.225
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C3H8OS2
Phân tử khối
124.225
Monoisotopic mass
124.001656258
InChI
InChI=1S/C3H8OS2/c1-5-3-6(2)4/h3H2,1-2H3/t6-/m1/s1
InChI Key
InChIKey=OTKFCIVOVKCFHR-ZCFIWIBFSA-N
IUPAC Name
(R)-methanesulfinyl(methylsulfanyl)methane
Traditional IUPAC Name
(R)-methanesulfinyl(methylsulfanyl)methane
SMILES
CSC[S@@](C)=O
Độ hòa tan
4.69e+01 g/l
logP
-0.56
logS
-0.42
pKa (Strongest Basic)
-6.6
PSA
17.07 Å2
Refractivity
32.76 m3·mol-1
Polarizability
12.85 Å3
Rotatable Bond Count
2
H Bond Acceptor Count
1
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/DB02311
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=11892832
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46507571
ChemSpider
http://www.chemspider.com/Chemical-Structure.89552.html
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