tert-butylazanium hydroxide

C4H13NO — CID 15767025

IUPACtert-butylazanium hydroxide
SMILESCC(C)(C)[NH3+].[OH-]
InChIInChI=1S/C4H11N.H2O/c1-4(2,3)5;/h5H2,1-3H3;1H2
InChIKeyJUWSCPBRVFRPFT-UHFFFAOYSA-N
MW91.15 g/mol
LogP-0.15
Rot. Bonds

About tert-butylazanium hydroxide

tert-butylazanium hydroxide (PubChem CID 15767025) has the molecular formula C4H13NO and a molecular weight of 91.15 g/mol. Its IUPAC name is tert-butylazanium hydroxide.

Molecular Properties

Compound Nametert-butylazanium hydroxide
PubChem CID15767025
Molecular FormulaC4H13NO
Molecular Weight91.15 g/mol
Exact Mass91.10
IUPAC Nametert-butylazanium hydroxide
SMILESCC(C)(C)[NH3+].[OH-]
InChIInChI=1S/C4H11N.H2O/c1-4(2,3)5;/h5H2,1-3H3;1H2
InChIKeyJUWSCPBRVFRPFT-UHFFFAOYSA-N
XLogP-0.15
TPSA57.64 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50091.15
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of tert-butylazanium hydroxide?
The IUPAC name of tert-butylazanium hydroxide (CID 15767025) is tert-butylazanium hydroxide.
What is the SMILES notation for tert-butylazanium hydroxide?
The canonical SMILES for tert-butylazanium hydroxide is CC(C)(C)[NH3+].[OH-].
What is the InChIKey of tert-butylazanium hydroxide?
The InChIKey is JUWSCPBRVFRPFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N.H2O/c1-4(2,3)5;/h5H2,1-3H3;1H2.
What are the key properties of tert-butylazanium hydroxide?
tert-butylazanium hydroxide has a molecular weight of 91.15 g/mol, XLogP of -0.15, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butylazanium hydroxide is sourced from PubChem (CID 15767025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).