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Chemical ID: 5001203
Chemical ID:
5001203
Name [?]:
9-(4-phenylphenyl)carbazole
SMILES [?]:
c1ccc(cc1)c2ccc(cc2)n3c4ccccc4c5c3cccc5
InChi [?]:
InChI=1/C24H17N/c1-2-8-18(9-3-1)19-14-16-20(17-15-19)25-23-12-6-4-10-21(23)22-11-5-7-13-24(22)25/h1-17H
InChi Info:
AuxInfo=1/0/N:1,2,6,17,24,16,23,3,5,18,25,15,22,8,12,9,11,4,7,10,19,20,14,21,13/E:(2,3)(4,5)(6,7)(8,9)(10,11)(12,13)(14,15)(16,17)(21,22)(23,24)/rA:25nCCCCCCCCCCCCNCCCCCCCCCCCC/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s9;d10;d7s11;s10;s13;s14;d15;s16;d17;d14s18;s19;s13s20;d21;s22;d23;d20s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C24H17N |
All Atoms: | 25 |
Heavy Atoms: | 25 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 11.5781 |
Area: | 527.961 |
Solvation: | -1.62094 |
Coulombic: | -11.1812 |
Bond Count [?]
All: | 29 |
Single: | 17 |
Double: | 12 |
Rotors: | 2 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 319.399 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 0 |
XLogP: | 7.34 |
LogP (Chemaxon): | 7.18 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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