Chemical ID: 6148050

c1ccc(c(c1)c2ccccc2OCC(=O)O)OCC(=O)O
Chemical ID:
6148050
Name [?]:
2-[2-[2-(carboxymethoxy)phenyl]phenoxy]acetic acid
SMILES [?]:
c1ccc(c(c1)c2ccccc2OCC(=O)O)OCC(=O)O
InChi [?]:
InChI=1/C16H14O6/c17-15(18)9-21-13-7-3-1-5-11(13)12-6-2-4-8-14(12)22-10-16(19)20/h1-8H,9-10H2,(H,17,18)(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,9,2,10,6,8,3,11,19,14,5,7,4,12,20,15,21,22,16,17,18,13/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)(17,18,19,20)(21,22)/gE:(1,2)/rA:22nCCCCCCCCCCCCOCCOOOCCOO/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s9;d10;d7s11;s12;s13;s14;d15;s15;s4;s18;s19;d20;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H14O6
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:5.91389
Area:492.463
Solvation:-6.3977
Coulombic:-68.9306
Bond Count [?]
All:23
Single:15
Double:8
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:302.279
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:2.56
LogP (Chemaxon):2.31

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Descriptor Annotations

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