1-ethoxyhexan-2-ol

C8H18O2 — CID 15270320

IUPAC1-ethoxyhexan-2-ol
SMILESCCCCC(O)COCC
InChIInChI=1S/C8H18O2/c1-3-5-6-8(9)7-10-4-2/h8-9H,3-7H2,1-2H3
InChIKeyRSXACUXDLRTLSM-UHFFFAOYSA-N
MW146.23 g/mol
LogP1.57
Rot. Bonds6

About 1-ethoxyhexan-2-ol

1-ethoxyhexan-2-ol (PubChem CID 15270320) has the molecular formula C8H18O2 and a molecular weight of 146.23 g/mol. Its IUPAC name is 1-ethoxyhexan-2-ol.

Molecular Properties

Compound Name1-ethoxyhexan-2-ol
PubChem CID15270320
Molecular FormulaC8H18O2
Molecular Weight146.23 g/mol
Exact Mass146.13
IUPAC Name1-ethoxyhexan-2-ol
SMILESCCCCC(O)COCC
InChIInChI=1S/C8H18O2/c1-3-5-6-8(9)7-10-4-2/h8-9H,3-7H2,1-2H3
InChIKeyRSXACUXDLRTLSM-UHFFFAOYSA-N
XLogP1.57
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Glycol monohexyl ether
CID 8170
Diethylene glycol monohexyl ether
CID 8199
3-Hexyloxypropylene glycol
CID 11229094
Octyl-sepharose CL-4B
CID 112041
Tetrahydropyran-2-methanol
CID 7524
Triethylene glycol hexyl ether
CID 94362
1-O-Dodecylglycerol
CID 97774
1-Propanol, 2-(dodecyloxy)-
CID 9834713
Cyclohexanol, 2-ethoxy-
CID 98428
3-(Cyclohexyloxy)propane-1,2-diol
CID 231081
Ethanol, 2-(heptyloxy)-
CID 23889
2-(2-(Heptyloxy)ethoxy)ethanol
CID 33261

Frequently Asked Questions

What is the IUPAC name of 1-ethoxyhexan-2-ol?
The IUPAC name of 1-ethoxyhexan-2-ol (CID 15270320) is 1-ethoxyhexan-2-ol.
What is the SMILES notation for 1-ethoxyhexan-2-ol?
The canonical SMILES for 1-ethoxyhexan-2-ol is CCCCC(O)COCC.
What is the InChIKey of 1-ethoxyhexan-2-ol?
The InChIKey is RSXACUXDLRTLSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O2/c1-3-5-6-8(9)7-10-4-2/h8-9H,3-7H2,1-2H3.
What are the key properties of 1-ethoxyhexan-2-ol?
1-ethoxyhexan-2-ol has a molecular weight of 146.23 g/mol, XLogP of 1.57, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxyhexan-2-ol is sourced from PubChem (CID 15270320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).