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2,4,6-Tris[(dibutylamino)methyl]phenol

HCID 225474
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Basic information

CAS
81116-67-8
Standard SMILES
CCCCN(CCCC)Cc1cc(CN(CCCC)CCCC)c(O)c(CN(CCCC)CCCC)c1
InChIKey
MILOSZNMUZXSFM-UHFFFAOYSA-N
Molecular formula
C33H63N3O
Average molar mass
517.9 g/mol
Monoisotopic mass
517.49711364

Names & identifiers

Preferred name
2,4,6-Tris[(dibutylamino)methyl]phenol
IUPAC
2,4,6-tris[(dibutylamino)methyl]phenol

Names & synonyms

2,4,6-tris[(dibutylamino)methyl]phenol81116-67-8NSC14895SCHEMBL14840227DTXSID701001787NSC-14895alpha2, alpha4,alpha6-Tris(dibutylamino)mesitol

Database identifiers

CAS
81116-67-8
PubChem CID
225474
DTXSID
DTXSID701001787

Properties

Computed structural properties

XLogP
8.6
Topological polar surface area
30 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
24
Heavy atoms
37
Formal charge
0
Complexity
446

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