CAS: 315-14-0
이름: 1,3,5-trifluoro-2-nitrobenzene
SMILES:
C1=C(C=C(C(=C1F)[N+](=O)[O-])F)FMolecular Processing
Molecular formula
C6H2F3NO2
Molecular weight
177.08
Exact mass
177.0038
XLogP
2.01
TPSA
43.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
32.97
Supplementary Information
InChIKey: PWRFDGYYJWQIAB-UHFFFAOYSA-N
동의어
1,3,5-Trifluoro-2-nitrobenzene315-14-02,4,6-TrifluoronitrobenzeneBenzene, 1,3,5-trifluoro-2-nitro-EINECS 206-248-8PWRFDGYYJWQIAB-UHFFFAOYSA-DTXSID80185400NSC 10247RefChem:72336DTXCID50107891206-248-8InChI=1/C6H2F3NO2/c7-3-1-4(8)6(10(11)12)5(9)2-3/h1-2HPWRFDGYYJWQIAB-UHFFFAOYSA-NMFCD000146871,3,5-trifluoro-2-nitro-benzeneNSC-102472,2,6-trifluoronitrobenzeneNSC10247L3XM2GS9E41,3,5-trifluoronitrobenzene2,4,6 trifluoronitrobenzeneSCHEMBL104470SCHEMBL17347356SCHEMBL286079002,4,6-trifluoro-1-nitrobenzene2,4,6-Trifluoronitrobenzene, 98%SBB063643AKOS006223684AC-1783CS-W020685
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