Chemical ID: 5250661

Cc1ccc(cc1OCCO)C(C)C
Chemical ID:
5250661
Name [?]:
2-(5-isopropyl-2-methyl-phenoxy)ethanol
SMILES [?]:
Cc1ccc(cc1OCCO)C(C)C
InChi [?]:
InChI=1/C12H18O2/c1-9(2)11-5-4-10(3)12(8-11)14-7-6-13/h4-5,8-9,13H,6-7H2,1-3H3
InChi Info:
AuxInfo=1/0/N:13,14,1,3,4,10,9,6,12,2,5,7,11,8/E:(1,2)/rA:14nCCCCCCCOCCOCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s10;s5;s12;s12;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H18O2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.24643
Area:389.388
Solvation:-3.48828
Coulombic:-24.9488
Bond Count [?]
All:14
Single:11
Double:3
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:194.27
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.86
LogP (Chemaxon):3.01

Name Annotations

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Descriptor Annotations

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