Chemical ID: 6472811

c1ccc-2c(c1)CC(=O)Cc3c2cccc3
Chemical ID:
6472811
Name [?]:
None
SMILES [?]:
c1ccc-2c(c1)CC(=O)Cc3c2cccc3
InChi [?]:
InChI=1/C15H12O/c16-13-9-11-5-1-3-7-14(11)15-8-4-2-6-12(15)10-13/h1-8H,9-10H2
InChi Info:
AuxInfo=1/0/N:1,15,2,14,6,16,3,13,7,10,5,11,8,4,12,9/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(14,15)/rA:16nCCCCCCCCOCCCCCCC/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;s10;s4s11;d12;s13;d14;d11s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H12O
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.4234
Area:369.363
Solvation:-1.81067
Coulombic:-9.70501
Bond Count [?]
All:18
Single:11
Double:7
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:208.255
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.16
LogP (Chemaxon):3.71

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Descriptor Annotations

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