Chemical ID: 4952779

CC1CCc2c3ccccc3[nH]c2C1
Chemical ID:
4952779
Name [?]:
2-methyl-2,3,4,9-tetrahydro-1H-carbazole
SMILES [?]:
CC1CCc2c3ccccc3[nH]c2C1
InChi [?]:
InChI=1/C13H15N/c1-9-6-7-11-10-4-2-3-5-12(10)14-13(11)8-9/h2-5,9,14H,6-8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,8,9,7,10,3,4,14,2,6,5,11,13,12/rA:14cCCCCCCCCCCCNCC/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s11;d5s12;s2s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H15N
All Atoms:14
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:7.76433
Area:347.264
Solvation:-0.917266
Coulombic:-12.548
Bond Count [?]
All:16
Single:12
Double:4
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:185.265
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.44
LogP (Chemaxon):3.62

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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