ethoxyethane;2-methylpentane-2,4-diol

C10H24O3 — CID 19391902

IUPACethoxyethane;2-methylpentane-2,4-diol
SMILESCC(O)CC(C)(C)O.CCOCC
InChIInChI=1S/C6H14O2.C4H10O/c1-5(7)4-6(2,3)8;1-3-5-4-2/h5,7-8H,4H2,1-3H3;3-4H2,1-2H3
InChIKeyYFWCUJIEYXNIBO-UHFFFAOYSA-N
MW192.30 g/mol
LogP1.57
Rot. Bonds4

About ethoxyethane;2-methylpentane-2,4-diol

ethoxyethane;2-methylpentane-2,4-diol (PubChem CID 19391902) has the molecular formula C10H24O3 and a molecular weight of 192.30 g/mol. Its IUPAC name is ethoxyethane;2-methylpentane-2,4-diol.

Molecular Properties

Compound Nameethoxyethane;2-methylpentane-2,4-diol
PubChem CID19391902
Molecular FormulaC10H24O3
Molecular Weight192.30 g/mol
Exact Mass192.17
IUPAC Nameethoxyethane;2-methylpentane-2,4-diol
SMILESCC(O)CC(C)(C)O.CCOCC
InChIInChI=1S/C6H14O2.C4H10O/c1-5(7)4-6(2,3)8;1-3-5-4-2/h5,7-8H,4H2,1-3H3;3-4H2,1-2H3
InChIKeyYFWCUJIEYXNIBO-UHFFFAOYSA-N
XLogP1.57
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.30
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methylpentane-2,4-diol
CID 7870
butyl acetate;ethoxyethane;2-methylpentane-2,4-diol
CID 166791403
1-butoxybutane;2-methylpentane-2,4-diol
CID 19966802
2-methylpentane-2,4-diol;2-methyl-2-propylpropane-1,3-diol
CID 88709547
4-[2-(4-hydroxy-2-methylpentan-2-yl)peroxypropan-2-ylperoxy]-4-methylpentan-2-ol
CID 139945230
4-methylheptane-2,4,6-triol
CID 90439710
ethene;ethoxyethane;propane-1,2-diol
CID 87065647
ethoxyethane;(2S)-pentan-2-ol
CID 157362053
ethoxyethane;hydroxylamine
CID 135816400
benzene-1,2-diamine;2-methylpentane-2,4-diol
CID 174865255
2,4-dimethylheptane-2,6-diol
CID 53400290
cyclohexane-1,1-diamine;2-methylpentane-2,4-diol
CID 174848693

Frequently Asked Questions

What is the IUPAC name of ethoxyethane;2-methylpentane-2,4-diol?
The IUPAC name of ethoxyethane;2-methylpentane-2,4-diol (CID 19391902) is ethoxyethane;2-methylpentane-2,4-diol.
What is the SMILES notation for ethoxyethane;2-methylpentane-2,4-diol?
The canonical SMILES for ethoxyethane;2-methylpentane-2,4-diol is CC(O)CC(C)(C)O.CCOCC.
What is the InChIKey of ethoxyethane;2-methylpentane-2,4-diol?
The InChIKey is YFWCUJIEYXNIBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O2.C4H10O/c1-5(7)4-6(2,3)8;1-3-5-4-2/h5,7-8H,4H2,1-3H3;3-4H2,1-2H3.
What are the key properties of ethoxyethane;2-methylpentane-2,4-diol?
ethoxyethane;2-methylpentane-2,4-diol has a molecular weight of 192.30 g/mol, XLogP of 1.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxyethane;2-methylpentane-2,4-diol is sourced from PubChem (CID 19391902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).