Chemical ID: 4163001

c1ccc(c(c1)COc2ccccc2C=O)Cl
Chemical ID:
4163001
Name [?]:
2-[(2-chlorophenyl)methoxy]benzaldehyde
SMILES [?]:
c1ccc(c(c1)COc2ccccc2C=O)Cl
InChi [?]:
InChI=1/C14H11ClO2/c15-13-7-3-1-6-12(13)10-17-14-8-4-2-5-11(14)9-16/h1-9H,10H2
InChi Info:
AuxInfo=1/0/N:1,12,2,11,13,6,3,10,15,7,14,5,4,9,17,16,8/rA:17nCCCCCCCOCCCCCCCOCl/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;s9;d10;s11;d12;d9s13;s14;d15;s4;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H11ClO2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.46138
Area:432.669
Solvation:-2.35535
Coulombic:-18.6404
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:3.96
LogP (Chemaxon):3.76

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Descriptor Annotations

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