Chemical ID: 5049739

CCCCC(CC)COCC(C)O
Chemical ID:
5049739
Name [?]:
1-(2-ethylhexoxy)propan-2-ol
SMILES [?]:
CCCCC(CC)COCC(C)O
InChi [?]:
InChI=1/C11H24O2/c1-4-6-7-11(5-2)9-13-8-10(3)12/h10-12H,4-9H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,7,12,2,6,3,4,10,8,11,5,13,9/rA:13cCCCCCCCCOCCCO/rB:s1;s2;s3;s4;s5;s6;s5;s8;s9;s10;s11;s11;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H24O2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:2
ZAP Information [?]
Total:7.02647
Area:416.781
Solvation:-3.39305
Coulombic:-26.0329
Bond Count [?]
All:12
Single:12
Double:0
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:188.307
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.12
LogP (Chemaxon):2.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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