Chemical ID: 6693304

c1cc2c(cc1O)c(c[nH]2)CCO
Chemical ID:
6693304
Name [?]:
3-(2-hydroxyethyl)-1H-indol-5-ol
SMILES [?]:
c1cc2c(cc1O)c(c[nH]2)CCO
InChi [?]:
InChI=1/C10H11NO2/c12-4-3-7-6-11-10-2-1-8(13)5-9(7)10/h1-2,5-6,11-13H,3-4H2
InChi Info:
AuxInfo=1/0/N:1,2,11,12,5,9,8,6,4,3,10,13,7/rA:13nCCCCCCOCCNCCO/rB:s1;d2;s3;d4;d1s5;s6;s4;d8;s3s9;s8;s11;s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H11NO2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:5.68387
Area:346.42
Solvation:-2.97662
Coulombic:-43.3413
Bond Count [?]
All:14
Single:10
Double:4
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:177.2
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:1.03
LogP (Chemaxon):1.88

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue