2,3-dimethyl-2-propan-2-yloxybutane

C9H20O — CID 13316174

IUPAC2,3-dimethyl-2-propan-2-yloxybutane
SMILESCC(C)OC(C)(C)C(C)C
InChIInChI=1S/C9H20O/c1-7(2)9(5,6)10-8(3)4/h7-8H,1-6H3
InChIKeyHWSZQDNHIHDEAM-UHFFFAOYSA-N
MW144.26 g/mol
LogP2.85
Rot. Bonds3

About 2,3-dimethyl-2-propan-2-yloxybutane

2,3-dimethyl-2-propan-2-yloxybutane (PubChem CID 13316174) has the molecular formula C9H20O and a molecular weight of 144.26 g/mol. Its IUPAC name is 2,3-dimethyl-2-propan-2-yloxybutane.

Molecular Properties

Compound Name2,3-dimethyl-2-propan-2-yloxybutane
PubChem CID13316174
Molecular FormulaC9H20O
Molecular Weight144.26 g/mol
Exact Mass144.15
IUPAC Name2,3-dimethyl-2-propan-2-yloxybutane
SMILESCC(C)OC(C)(C)C(C)C
InChIInChI=1S/C9H20O/c1-7(2)9(5,6)10-8(3)4/h7-8H,1-6H3
InChIKeyHWSZQDNHIHDEAM-UHFFFAOYSA-N
XLogP2.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.26
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-2-propan-2-yloxybutane?
The IUPAC name of 2,3-dimethyl-2-propan-2-yloxybutane (CID 13316174) is 2,3-dimethyl-2-propan-2-yloxybutane.
What is the SMILES notation for 2,3-dimethyl-2-propan-2-yloxybutane?
The canonical SMILES for 2,3-dimethyl-2-propan-2-yloxybutane is CC(C)OC(C)(C)C(C)C.
What is the InChIKey of 2,3-dimethyl-2-propan-2-yloxybutane?
The InChIKey is HWSZQDNHIHDEAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O/c1-7(2)9(5,6)10-8(3)4/h7-8H,1-6H3.
What are the key properties of 2,3-dimethyl-2-propan-2-yloxybutane?
2,3-dimethyl-2-propan-2-yloxybutane has a molecular weight of 144.26 g/mol, XLogP of 2.85, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-2-propan-2-yloxybutane is sourced from PubChem (CID 13316174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).