2-(Aminomethyl)-4-tert-butyl-6-methylsulfanylphenol

HCID 12652152
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Basic information

Standard SMILES
CSc1cc(C(C)(C)C)cc(CN)c1O
InChIKey
ZENBEAYMYRZPNL-UHFFFAOYSA-N
Molecular formula
C12H19NOS
Average molar mass
225.35 g/mol
Monoisotopic mass
225.1187354

Names & identifiers

Preferred name
2-(Aminomethyl)-4-tert-butyl-6-methylsulfanylphenol
IUPAC
2-(aminomethyl)-4-tert-butyl-6-methylsulfanylphenol

Names & synonyms

61626-88-8CHEMBL1189651SCHEMBL11496345DA-27919

Database identifiers

PubChem CID
12652152
ChEMBL
CHEMBL1189651

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
71.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
15

Related reactions

1 records
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Compound notes

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