Chemical ID: 4952079

CCCCC(C1CCCCC1)C(=O)O
Chemical ID:
4952079
Name [?]:
2-cyclohexylhexanoic acid
SMILES [?]:
CCCCC(C1CCCCC1)C(=O)O
InChi [?]:
InChI=1/C12H22O2/c1-2-3-9-11(12(13)14)10-7-5-4-6-8-10/h10-11H,2-9H2,1H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,2,3,9,8,10,7,11,4,6,5,12,13,14/E:(5,6)(7,8)(13,14)/rA:14cCCCCCCCCCCCCOO/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;s6s10;s5;d12;s12;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H22O2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:8.39524
Area:386.387
Solvation:-1.26444
Coulombic:-28.5748
Bond Count [?]
All:14
Single:13
Double:1
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:198.302
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.62
LogP (Chemaxon):3.62

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