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17755-17-8 | Phenol, 2,6-bis[(dimethylamino)methyl]-4-nonyl-
CAS No: 17755-17-8 Catalog No: AG0025EE MDL No:
Product Description
Catalog Number:
AG0025EE
Chemical Name:
Phenol, 2,6-bis[(dimethylamino)methyl]-4-nonyl-
CAS Number:
17755-17-8
Molecular Formula:
C21H38N2O
Molecular Weight:
334.5392
IUPAC Name:
2,6-bis[(dimethylamino)methyl]-4-nonylphenol
InChI:
InChI=1S/C21H38N2O/c1-6-7-8-9-10-11-12-13-18-14-19(16-22(2)3)21(24)20(15-18)17-23(4)5/h14-15,24H,6-13,16-17H2,1-5H3
InChI Key:
NNURPGZOGPWGMS-UHFFFAOYSA-N
SMILES:
CCCCCCCCCc1cc(CN(C)C)c(c(c1)CN(C)C)O
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.298g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
334.548g/mol
Monoisotopic Mass:
334.298g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
26.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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