Chemical ID: 5576751

Cc1ccc(cc1)C(=O)c2ccccc2
Chemical ID:
5576751
Name [?]:
phenyl-(p-tolyl)methanone
SMILES [?]:
Cc1ccc(cc1)C(=O)c2ccccc2
InChi [?]:
InChI=1/C14H12O/c1-11-7-9-13(10-8-11)14(15)12-5-3-2-4-6-12/h2-10H,1H3
InChi Info:
AuxInfo=1/0/N:1,13,12,14,11,15,3,7,4,6,2,10,5,8,9/E:(3,4)(5,6)(7,8)(9,10)/rA:15nCCCCCCCCOCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;s8;s10;d11;s12;d13;d10s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H12O
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.9495
Area:377.098
Solvation:-1.47795
Coulombic:-12.156
Bond Count [?]
All:16
Single:9
Double:7
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:196.244
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:4.01
LogP (Chemaxon):3.74

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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