Tìm theo
5-(2-CHLORO-4-NITROPHENYL)-2-FUROIC ACID
Thuốc Gốc
Small Molecule
CTHH: C11H6ClNO5
PTK: 267.622
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
Phân tử khối
267.622
Monoisotopic mass
266.993450014
InChI
InChI=1S/C11H6ClNO5/c12-8-5-6(13(16)17)1-2-7(8)9-3-4-10(18-9)11(14)15/h1-5H,(H,14,15)
InChI Key
InChIKey=HDIHNBCCQWMVBW-UHFFFAOYSA-N
IUPAC Name
5-(2-chloro-4-nitrophenyl)furan-2-carboxylic acid
Traditional IUPAC Name
5-(2-chloro-4-nitrophenyl)furan-2-carboxylic acid
SMILES
OC(=O)C1=CC=C(O1)C1=CC=C(C=C1Cl)[N+]([O-])=O
Độ hòa tan
3.96e-02 g/l
logP
2.8
logS
-3.8
pKa (strongest acidic)
3.13
pKa (Strongest Basic)
-4.8
PSA
96.26 Å2
Refractivity
62.85 m3·mol-1
Polarizability
23.74 Å3
Rotatable Bond Count
3
H Bond Acceptor Count
4
H Bond Donor Count
1
Physiological Charge
-1
Number of Rings
2
Bioavailability
1
Rule of Five
true
Ghose Filter
true
... loading
... loading