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Chemical ID: 5616083
Chemical ID:
5616083
Name [?]:
1-(9H-carbazol-2-yl)ethanone
SMILES [?]:
CC(=O)c1ccc2c3ccccc3[nH]c2c1
InChi [?]:
InChI=1/C14H11NO/c1-9(16)10-6-7-12-11-4-2-3-5-13(11)15-14(12)8-10/h2-8,15H,1H3
InChi Info:
AuxInfo=1/0/N:1,10,11,9,12,5,6,16,2,4,8,7,13,15,14,3/rA:16nCCOCCCCCCCCCCNCC/rB:s1;d2;s2;s4;d5;s6;s7;s8;d9;s10;d11;d8s12;s13;d7s14;d4s15;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H11NO |
All Atoms: | 16 |
Heavy Atoms: | 16 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.33326 |
Area: | 382.505 |
Solvation: | -2.22938 |
Coulombic: | -19.7812 |
Bond Count [?]
All: | 18 |
Single: | 11 |
Double: | 7 |
Rotors: | 1 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 209.243 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 1 |
XLogP: | 3.37 |
LogP (Chemaxon): | 3.15 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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