Chemical ID: 7089909

COc1ccccc1c2cccc(c2)CC(=O)O
Chemical ID:
7089909
Name [?]:
2-[3-(2-methoxyphenyl)phenyl]acetic acid
SMILES [?]:
COc1ccccc1c2cccc(c2)CC(=O)O
InChi [?]:
InChI=1/C15H14O3/c1-18-14-8-3-2-7-13(14)12-6-4-5-11(9-12)10-15(16)17/h2-9H,10H2,1H3,(H,16,17)
InChi Info:
AuxInfo=1/1/N:1,6,5,11,12,10,7,4,14,15,13,9,8,3,16,17,18,2/E:(16,17)/rA:18nCOCCCCCCCCCCCCCCOO/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s11;d12;d9s13;s13;s15;d16;s16;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14O3
All Atoms:32
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:7.04821
Area:431.711
Solvation:-3.74456
Coulombic:-34.8951
Bond Count [?]
All:19
Single:12
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:242.27
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.3
LogP (Chemaxon):3.11

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Descriptor Annotations

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