Chemical ID: 6683743

c1ccc(c(c1)C=CC(=O)O)O
Chemical ID:
6683743
Name [?]:
3-(2-hydroxyphenyl)prop-2-enoic acid
SMILES [?]:
c1ccc(c(c1)C=CC(=O)O)O
InChi [?]:
InChI=1/C9H8O3/c10-8-4-2-1-3-7(8)5-6-9(11)12/h1-6,10H,(H,11,12)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,7,8,5,4,9,12,10,11/E:(11,12)/rA:12nCCCCCCCCCOOO/rB:s1;d2;s3;d4;d1s5;s5;w7;s8;d9;s9;s4;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H8O3
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:5.36594
Area:314.667
Solvation:-2.50074
Coulombic:-43.9757
Bond Count [?]
All:12
Single:7
Double:5
Rotors:2
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:164.158
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:1.5
LogP (Chemaxon):1.87

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Descriptor Annotations

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