Chemical ID: 6635202

c1ccc2c(c1)ccc-3c2CCc4c3[nH]c5c4cccc5
Chemical ID:
6635202
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)ccc-3c2CCc4c3[nH]c5c4cccc5
InChi [?]:
InChI=1/C20H15N/c1-2-6-14-13(5-1)9-10-17-15(14)11-12-18-16-7-3-4-8-19(16)21-20(17)18/h1-10,21H,11-12H2
InChi Info:
AuxInfo=1/0/N:1,2,19,20,6,3,18,21,7,8,11,12,5,4,10,17,9,13,16,14,15/rA:21nCCCCCCCCCCCCCCNCCCCCC/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;s11;s12;s9d13;s14;s15;s13s16;d17;s18;d19;d16s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H15N
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.60593
Area:440.803
Solvation:-1.41414
Coulombic:-14.352
Bond Count [?]
All:25
Single:16
Double:9
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:269.34
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:5.42
LogP (Chemaxon):5.33

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