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102759-19-3 | Benzenamine, N-methyl-4-[(8-phenoxyoctyl)oxy]-
CAS No: 102759-19-3 Catalog No: AG0008AY MDL No:
Product Description
Catalog Number:
AG0008AY
Chemical Name:
Benzenamine, N-methyl-4-[(8-phenoxyoctyl)oxy]-
CAS Number:
102759-19-3
Molecular Formula:
C21H29NO2
Molecular Weight:
327.4605
IUPAC Name:
N-methyl-4-(8-phenoxyoctoxy)aniline
InChI:
InChI=1S/C21H29NO2/c1-22-19-13-15-21(16-14-19)24-18-10-5-3-2-4-9-17-23-20-11-7-6-8-12-20/h6-8,11-16,22H,2-5,9-10,17-18H2,1H3
InChI Key:
ZIOSLEJHBGKWMR-UHFFFAOYSA-N
SMILES:
CNc1ccc(cc1)OCCCCCCCCOc1ccccc1
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.22g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
327.468g/mol
Monoisotopic Mass:
327.22g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1
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