2-methyl-1-propan-2-yloxypropan-2-ol

C7H16O2 — CID 547751

IUPAC2-methyl-1-propan-2-yloxypropan-2-ol
SMILESCC(C)OCC(C)(C)O
InChIInChI=1S/C7H16O2/c1-6(2)9-5-7(3,4)8/h6,8H,5H2,1-4H3
InChIKeyIHGXRBJFCJZJSC-UHFFFAOYSA-N
MW132.20 g/mol
LogP1.18
Rot. Bonds3

About 2-methyl-1-propan-2-yloxypropan-2-ol

2-methyl-1-propan-2-yloxypropan-2-ol (PubChem CID 547751) has the molecular formula C7H16O2 and a molecular weight of 132.20 g/mol. Its IUPAC name is 2-methyl-1-propan-2-yloxypropan-2-ol.

Molecular Properties

Compound Name2-methyl-1-propan-2-yloxypropan-2-ol
PubChem CID547751
Molecular FormulaC7H16O2
Molecular Weight132.20 g/mol
Exact Mass132.12
IUPAC Name2-methyl-1-propan-2-yloxypropan-2-ol
SMILESCC(C)OCC(C)(C)O
InChIInChI=1S/C7H16O2/c1-6(2)9-5-7(3,4)8/h6,8H,5H2,1-4H3
InChIKeyIHGXRBJFCJZJSC-UHFFFAOYSA-N
XLogP1.18
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.20
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-1-propan-2-yloxypropan-2-ol
CID 57307102
3-amino-2-methyl-1-propan-2-yloxybutan-2-ol
CID 130574290
3-methyl-2-(propan-2-yloxymethyl)butane-1,2,3-triol
CID 89015662
3,3-dimethyl-4-propan-2-yloxybutanoic acid
CID 81004424
N,N,2,2-tetramethyl-3-propan-2-yloxypropan-1-amine
CID 58303667
3-fluoro-3-methyl-4-propan-2-yloxybutanoic acid
CID 105437453
4-(2-hydroxy-1-propan-2-yloxypropan-2-yl)benzonitrile
CID 115481716
2,2-dimethyl-N-propan-2-yl-3-propan-2-yloxypropan-1-amine
CID 79621622
1-bromo-2-methyl-2-(propan-2-yloxymethyl)butane
CID 165445799
1-(2-methoxypropoxy)-2-methylpropan-2-ol
CID 157369312
2-hydroxy-2-methyl-1-phenyl-3-propan-2-yloxypropan-1-one
CID 19878495
(E)-2,7,7-trimethyl-8-propan-2-yloxyoct-3-ene
CID 89254940

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-propan-2-yloxypropan-2-ol?
The IUPAC name of 2-methyl-1-propan-2-yloxypropan-2-ol (CID 547751) is 2-methyl-1-propan-2-yloxypropan-2-ol.
What is the SMILES notation for 2-methyl-1-propan-2-yloxypropan-2-ol?
The canonical SMILES for 2-methyl-1-propan-2-yloxypropan-2-ol is CC(C)OCC(C)(C)O.
What is the InChIKey of 2-methyl-1-propan-2-yloxypropan-2-ol?
The InChIKey is IHGXRBJFCJZJSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O2/c1-6(2)9-5-7(3,4)8/h6,8H,5H2,1-4H3.
What are the key properties of 2-methyl-1-propan-2-yloxypropan-2-ol?
2-methyl-1-propan-2-yloxypropan-2-ol has a molecular weight of 132.20 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-propan-2-yloxypropan-2-ol is sourced from PubChem (CID 547751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).