acetic acid;2-methoxy-1-propan-2-yloxypropane

C9H20O4 — CID 172787962

IUPACacetic acid;2-methoxy-1-propan-2-yloxypropane
SMILESCC(=O)O.COC(C)COC(C)C
InChIInChI=1S/C7H16O2.C2H4O2/c1-6(2)9-5-7(3)8-4;1-2(3)4/h6-7H,5H2,1-4H3;1H3,(H,3,4)
InChIKeyPDVXIRWDWGPEEW-UHFFFAOYSA-N
MW192.25 g/mol
LogP1.54
Rot. Bonds4

About acetic acid;2-methoxy-1-propan-2-yloxypropane

acetic acid;2-methoxy-1-propan-2-yloxypropane (PubChem CID 172787962) has the molecular formula C9H20O4 and a molecular weight of 192.25 g/mol. Its IUPAC name is acetic acid;2-methoxy-1-propan-2-yloxypropane.

Molecular Properties

Compound Nameacetic acid;2-methoxy-1-propan-2-yloxypropane
PubChem CID172787962
Molecular FormulaC9H20O4
Molecular Weight192.25 g/mol
Exact Mass192.14
IUPAC Nameacetic acid;2-methoxy-1-propan-2-yloxypropane
SMILESCC(=O)O.COC(C)COC(C)C
InChIInChI=1S/C7H16O2.C2H4O2/c1-6(2)9-5-7(3)8-4;1-2(3)4/h6-7H,5H2,1-4H3;1H3,(H,3,4)
InChIKeyPDVXIRWDWGPEEW-UHFFFAOYSA-N
XLogP1.54
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.25
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-propan-2-yloxypropan-2-yloxy)acetic acid
CID 87458706
2-ethoxy-2-(2-methoxypropoxy)acetic acid
CID 57284708
bis[2-(2-methoxypropoxy)propyl] carbonate
CID 139751195
2-hydroxypropanoic acid;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol
CID 86606253
2-hydroxy-3-(2-methoxypropoxy)butanedioate
CID 18717532
2-[2-(2-methoxypropoxy)propoxy]propyl 4-oxopentanoate
CID 88992784
azane;fluoro 2-(2-methoxypropoxy)propanoate
CID 175447358
4-(2-methoxypropoxy)-4-oxobut-2-enoic acid
CID 54339045
2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 87899211
2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 87903083
(4R)-4-methoxypentan-2-one
CID 10749159
(3S)-3-methoxybutanoic acid
CID 51374275

Frequently Asked Questions

What is the IUPAC name of acetic acid;2-methoxy-1-propan-2-yloxypropane?
The IUPAC name of acetic acid;2-methoxy-1-propan-2-yloxypropane (CID 172787962) is acetic acid;2-methoxy-1-propan-2-yloxypropane.
What is the SMILES notation for acetic acid;2-methoxy-1-propan-2-yloxypropane?
The canonical SMILES for acetic acid;2-methoxy-1-propan-2-yloxypropane is CC(=O)O.COC(C)COC(C)C.
What is the InChIKey of acetic acid;2-methoxy-1-propan-2-yloxypropane?
The InChIKey is PDVXIRWDWGPEEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O2.C2H4O2/c1-6(2)9-5-7(3)8-4;1-2(3)4/h6-7H,5H2,1-4H3;1H3,(H,3,4).
What are the key properties of acetic acid;2-methoxy-1-propan-2-yloxypropane?
acetic acid;2-methoxy-1-propan-2-yloxypropane has a molecular weight of 192.25 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;2-methoxy-1-propan-2-yloxypropane is sourced from PubChem (CID 172787962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).