Tìm theo
Decanoic Acid
Các tên gọi khác (1) :
  • Capric acid
antifungal agents
Thuốc Gốc
Small Molecule
CAS: 334-48-5
CTHH: C10H20O2
PTK: 172.2646
Decanoic acid is a solid. This compound belongs to the straight chain fatty acids. These are fatty acids with a straight aliphatic chain. The proteins that decanoic acid targets include furin, octanoyltransferase, 3-oxoacyl-[acyl-carrier-protein] synthase 1, peptostreptococcal albumin-binding protein, and putative uncharacterized protein tcp14.
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C10H20O2
Phân tử khối
172.2646
Monoisotopic mass
172.146329884
InChI
InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)
InChI Key
InChIKey=GHVNFZFCNZKVNT-UHFFFAOYSA-N
IUPAC Name
decanoic acid
Traditional IUPAC Name
decanoic acid
SMILES
CCCCCCCCCC(O)=O
Độ tan chảy
31.9 °C
Độ sôi
268.7 °C
Độ hòa tan
61.8 mg/L (at 25 °C)
logP
4.09
logS
-3.44
pKa (strongest acidic)
4.95
PSA
37.3 Å2
Refractivity
49.48 m3·mol-1
Polarizability
21.61 Å3
Rotatable Bond Count
8
H Bond Acceptor Count
2
H Bond Donor Count
1
Physiological Charge
-1
Number of Rings
0
Bioavailability
1
Rule of Five
true
Ghose Filter
true
pKa
4.9
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB03600
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=2969
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46509055
KEGG Compound
http://www.genome.jp/dbget-bin/www_bget?cpd:C01571
ChemSpider
http://www.chemspider.com/Chemical-Structure.2863.html
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