CAS: 401-95-6
이름: 3,5-bis(trifluoromethyl)benzaldehyde
SMILES:
C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C=OMolecular Processing
Molecular formula
C9H4F6O
Molecular weight
242.12
Exact mass
242.0166
XLogP
3.54
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
41.83
Supplementary Information
InChIKey: LDWLIXZSDPXYDR-UHFFFAOYSA-N
동의어
3,5-Bis(trifluoromethyl)benzaldehyde401-95-63,5-di(Trifluoromethyl)benzaldehydeLDWLIXZSDPXYDR-UHFFFAOYSA-DTXSID80193141RefChem:91381DTXCID90115632628-052-5InChI=1/C9H4F6O/c10-8(11,12)6-1-5(4-16)2-7(3-6)9(13,14)15/h1-4HLDWLIXZSDPXYDR-UHFFFAOYSA-NMFCD000102063,5-Bistrifluoromethylbenzaldehyde3,5-bis-trifluoromethyl-benzaldehydeBenzaldehyde, 3,5-bis(trifluoromethyl)-3,5-(Trifluoromethyl)benzaldehyde; 3,5-Ditrifluoromethylbenzaldehyde3,5-bis-(Trifluoromethyl)benzaldehydeSCHEMBL66819SCHEMBL728390CHEMBL5286407BIS-(Trifluoromethyl)benzaldehyde3,5 bistrifluoromethyl benzaldehyde3,5-Bis-trifluoromethylbenzaldehyde3,5-Bistrifluoromethyl benzaldehyde3,5-di(trifiuoromethyl)benzaldehyde3,5-Di(Trifluoromethyl)benzaldhyde3,5-bis-trifluoromethyl benzaldehydeCK2110SBB0066613,5-bis(trifluoromethyl) benzaldehyde3,5-bis(trifluoromethyl)-benzaldehyde
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