Chemical ID: 6684308

CC(=O)c1ccc2=c3ccccc3=c2c1
Chemical ID:
6684308
Name [?]:
1-biphenylen-2-ylethanone
SMILES [?]:
CC(=O)c1ccc2=c3ccccc3=c2c1
InChi [?]:
InChI=1/C14H10O/c1-9(15)10-6-7-13-11-4-2-3-5-12(11)14(13)8-10/h2-8H,1H3
InChi Info:
AuxInfo=1/0/N:1,10,11,9,12,5,6,15,2,4,8,13,7,14,3/rA:15nCCOCCCCCCCCCCCC/rB:s1;d2;s2;s4;d5;s6;d7;s8;d9;s10;d11;s8s12;s7d13;d4s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H10O
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.42116
Area:370.134
Solvation:-1.83218
Coulombic:-9.63711
Bond Count [?]
All:17
Single:10
Double:7
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:194.229
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.72
LogP (Chemaxon):2.63

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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