Chemical ID: 6922638

CCOc1cc(ccc1OCc2ccc(cc2Cl)F)C=O
Chemical ID:
6922638
Name [?]:
4-[(2-chloro-4-fluoro-phenyl)methoxy]-3-ethoxy-benzaldehyde
SMILES [?]:
CCOc1cc(ccc1OCc2ccc(cc2Cl)F)C=O
InChi [?]:
InChI=1/C16H14ClFO3/c1-2-20-16-7-11(9-19)3-6-15(16)21-10-12-4-5-13(18)8-14(12)17/h3-9H,2,10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,7,13,14,8,5,16,20,11,6,12,15,17,9,4,18,19,21,3,10/rA:21nCCOCCCCCCOCCCCCCCClFCO/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;s11;s12;d13;s14;d15;d12s16;s17;s15;s6;d20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H14ClFO3
All Atoms:35
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:6.69692
Area:504.226
Solvation:-5.90872
Coulombic:-26.2151
Bond Count [?]
All:22
Single:15
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:308.732
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:4.2
LogP (Chemaxon):3.99

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