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43141-69-1 | 3-(Dibutylamino)phenol
CAS No: 43141-69-1 Catalog No: AG003I7H MDL No:MFCD00134668
Product Description
Catalog Number:
AG003I7H
Chemical Name:
3-(Dibutylamino)phenol
CAS Number:
43141-69-1
Molecular Formula:
C14H23NO
Molecular Weight:
221.3385
MDL Number:
MFCD00134668
IUPAC Name:
3-(dibutylamino)phenol
InChI:
InChI=1S/C14H23NO/c1-3-5-10-15(11-6-4-2)13-8-7-9-14(16)12-13/h7-9,12,16H,3-6,10-11H2,1-2H3
InChI Key:
KHSTZMGCKHBFJX-UHFFFAOYSA-N
SMILES:
CCCCN(c1cccc(c1)O)CCCC
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.178g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.344g/mol
Monoisotopic Mass:
221.178g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Literature
| Title | Journal |
|---|---|
| Uterotrophic assay, Hershberger assay, and subacute oral toxicity study of 4,4'-butylidenebis(2-tert-butyl-5-methylphenol) and 3-(dibutylamino)phenol, based on the OECD draft protocols. | Archives of toxicology 20080501 |
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