Chemical ID: 4772405

c1ccc2c(c1)c3c([nH]2)CCC3
Chemical ID:
4772405
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)c3c([nH]2)CCC3
InChi [?]:
InChI=1/C11H11N/c1-2-6-10-8(4-1)9-5-3-7-11(9)12-10/h1-2,4,6,12H,3,5,7H2
InChi Info:
AuxInfo=1/0/N:1,2,11,6,12,3,10,5,7,4,8,9/rA:12nCCCCCCCCNCCC/rB:s1;d2;s3;d4;d1s5;s5;d7;s4s8;s8;s10;s7s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H11N
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.90491
Area:312.733
Solvation:-0.913406
Coulombic:-11.8935
Bond Count [?]
All:14
Single:10
Double:4
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:157.212
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:2.36
LogP (Chemaxon):2.89

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Descriptor Annotations

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