Chemical ID: 5228601

COc1ccc2c(c1)[nH]c3c2CCCC3
Chemical ID:
5228601
Name [?]:
2-methoxy-6,7,8,9-tetrahydro-5H-carbazole
SMILES [?]:
COc1ccc2c(c1)[nH]c3c2CCCC3
InChi [?]:
InChI=1/C13H15NO/c1-15-9-6-7-11-10-4-2-3-5-12(10)14-13(11)8-9/h6-8,14H,2-5H2,1H3
InChi Info:
AuxInfo=1/0/N:1,13,14,12,15,4,5,8,3,11,6,10,7,9,2/rA:15nCOCCCCCCNCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;s9;s6d10;s11;s12;s13;s10s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H15NO
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:6.95439
Area:366.291
Solvation:-2.20289
Coulombic:-18.4646
Bond Count [?]
All:17
Single:13
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:201.264
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.85
LogP (Chemaxon):3.04

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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