1-(3-Tert-butyl-4-dimethylaminophenyl)prop-2-yn-1-ol

HCID 86646567
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Basic information

Standard SMILES
C#CC(O)c1ccc(N(C)C)c(C(C)(C)C)c1
InChIKey
UWGANBDSNWIYIN-UHFFFAOYSA-N
Molecular formula
C15H21NO
Average molar mass
231.33 g/mol
Monoisotopic mass
231.16231429

Names & identifiers

Preferred name
1-(3-Tert-butyl-4-dimethylaminophenyl)prop-2-yn-1-ol
IUPAC
1-[3-tert-butyl-4-(dimethylamino)phenyl]prop-2-yn-1-ol

Names & synonyms

SCHEMBL2098921UWGANBDSNWIYIN-UHFFFAOYSA-N1-(3-tert-butyl-4-dimethylaminophenyl)prop-2-yn-1-ol

Database identifiers

PubChem CID
86646567

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
23.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
17

Related reactions

4 records
New reaction record

Compound notes

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