(6e)-6-[(2e,4e,6e)-3,7-Dimethylnona-2,4,6,8-Tetraenylidene]-1,5,5-Trimethylcyclohexene
Thuốc Gốc
Small Molecule
CTHH: C20H28
PTK: 268.4363
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
Phân tử khối
268.4363
Monoisotopic mass
268.219100896
InChI
InChI=1S/C20H28/c1-7-16(2)10-8-11-17(3)13-14-19-18(4)12-9-15-20(19,5)6/h7-8,10-14H,1,9,15H2,2-6H3/b11-8+,16-10+,17-13+,19-14+
InChI Key
InChIKey=FWNRILWHNGFAIN-SSHGZYQJSA-N
IUPAC Name
(6Z)-6-[(2E,4E,6E)-3,7-dimethylnona-2,4,6,8-tetraen-1-ylidene]-1,5,5-trimethylcyclohex-1-ene
Traditional IUPAC Name
(6Z)-6-[(2E,4E,6E)-3,7-dimethylnona-2,4,6,8-tetraen-1-ylidene]-1,5,5-trimethylcyclohex-1-ene
SMILES
C\C(C=C)=C/C=C/C(/C)=C/C=C1\C(C)=CCCC1(C)C
Độ hòa tan
2.23e-03 g/l
logP
5.67
logS
-5.1
Refractivity
96.19 m3·mol-1
Polarizability
34.41 Å3
Polar Surface Area (PSA)
0
Rotatable Bond Count
4
H Bond Acceptor Count
0
H Bond Donor Count
0
Physiological Charge
0
Number of Rings
1
Bioavailability
1
Tài Liệu Tham Khảo Thêm
drugbank
PubChem Compound
PubChem Substance
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