Chemical ID: 6637722

COc1cccc2c1[nH]cc2C=O
Chemical ID:
6637722
Name [?]:
7-methoxy-1H-indole-3-carbaldehyde
SMILES [?]:
COc1cccc2c1[nH]cc2C=O
InChi [?]:
InChI=1/C10H9NO2/c1-13-9-4-2-3-8-7(6-12)5-11-10(8)9/h2-6,11H,1H3
InChi Info:
AuxInfo=1/0/N:1,5,6,4,10,12,11,7,3,8,9,13,2/rA:13nCOCCCCCCNCCCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;s7d10;s11;d12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H9NO2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:4.73306
Area:337.008
Solvation:-3.69214
Coulombic:-25.3903
Bond Count [?]
All:14
Single:9
Double:5
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:175.184
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.7
LogP (Chemaxon):1.87

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