Chemical ID: 5816469

c1ccc(c(c1)C=O)OCc2cccc(c2)Cl
Chemical ID:
5816469
Name [?]:
2-[(3-chlorophenyl)methoxy]benzaldehyde
SMILES [?]:
c1ccc(c(c1)C=O)OCc2cccc(c2)Cl
InChi [?]:
InChI=1/C14H11ClO2/c15-13-6-3-4-11(8-13)10-17-14-7-2-1-5-12(14)9-16/h1-9H,10H2
InChi Info:
AuxInfo=1/0/N:1,2,13,12,6,14,3,16,7,10,11,5,15,4,17,8,9/rA:17nCCCCCCCOOCCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s5;d7;s4;s9;s10;s11;d12;s13;d14;d11s15;s15;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H11ClO2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.25627
Area:441.881
Solvation:-2.79075
Coulombic:-18.1205
Bond Count [?]
All:18
Single:11
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:246.689
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.97
LogP (Chemaxon):3.76

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Descriptor Annotations

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