Chemical ID: 7115821

C1CCC(C(C1)CC2CCCCC2O)O
Chemical ID:
7115821
Name [?]:
2-[(2-hydroxycyclohexyl)methyl]cyclohexan-1-ol
SMILES [?]:
C1CCC(C(C1)CC2CCCCC2O)O
InChi [?]:
InChI=1/C13H24O2/c14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)15/h10-15H,1-9H2
InChi Info:
AuxInfo=1/0/N:1,10,2,11,6,9,3,12,7,5,8,4,13,15,14/E:(1,2)(3,4)(5,6)(7,8)(10,11)(12,13)(14,15)/rA:15cCCCCCCCCCCCCCOO/rB:s1;s2;s3;s4;s1s5;s5;s7;s8;s9;s10;s11;s8s12;s13;s4;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H24O2
All Atoms:39
Heavy Atoms:15
Chiral Atoms:4
ZAP Information [?]
Total:7.21892
Area:385.709
Solvation:-2.42382
Coulombic:-34.8304
Bond Count [?]
All:16
Single:16
Double:0
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:212.328
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:2.55
LogP (Chemaxon):2.54

Name Annotations

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Descriptor Annotations

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