Chemical ID: 4117696

c1cc(ccc1COc2ccc(cc2)C=O)F
Chemical ID:
4117696
Name [?]:
4-[(4-fluorophenyl)methoxy]benzaldehyde
SMILES [?]:
c1cc(ccc1COc2ccc(cc2)C=O)F
InChi [?]:
InChI=1/C14H11FO2/c15-13-5-1-12(2-6-13)10-17-14-7-3-11(9-16)4-8-14/h1-9H,10H2
InChi Info:
AuxInfo=1/0/N:1,5,11,13,2,4,10,14,15,7,12,6,3,9,17,16,8/E:(1,2)(3,4)(5,6)(7,8)/rA:17nCCCCCCCOCCCCCCCOF/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;s9;d10;s11;d12;d9s13;s12;d15;s3;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H11FO2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:5.86662
Area:414.798
Solvation:-4.50332
Coulombic:-19.6107
Bond Count [?]
All:18
Single:11
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:230.234
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.5
LogP (Chemaxon):3.39

Name Annotations

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Descriptor Annotations

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