Chemical ID: 5571621

c1ccc(cc1)CCCC(c2ccccc2)C(=O)O
Chemical ID:
5571621
Name [?]:
2,5-diphenylpentanoic acid
SMILES [?]:
c1ccc(cc1)CCCC(c2ccccc2)C(=O)O
InChi [?]:
InChI=1/C17H18O2/c18-17(19)16(15-11-5-2-6-12-15)13-7-10-14-8-3-1-4-9-14/h1-6,8-9,11-12,16H,7,10,13H2,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,14,2,6,13,15,8,3,5,7,12,16,9,4,11,10,17,18,19/E:(3,4)(5,6)(8,9)(11,12)(18,19)/rA:19cCCCCCCCCCCCCCCCCCOO/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;s11;d12;s13;d14;d11s15;s10;d17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H18O2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:9.63468
Area:469.095
Solvation:-2.09269
Coulombic:-30.4045
Bond Count [?]
All:20
Single:13
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:254.324
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.25
LogP (Chemaxon):4.65

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