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820209-44-7 | Benzenamine, N-(4,4-dimethoxybutyl)-
CAS No: 820209-44-7 Catalog No: AG004YTW MDL No:
Product Description
Catalog Number:
AG004YTW
Chemical Name:
Benzenamine, N-(4,4-dimethoxybutyl)-
CAS Number:
820209-44-7
Molecular Formula:
C12H19NO2
Molecular Weight:
209.2848
IUPAC Name:
N-(4,4-dimethoxybutyl)aniline
InChI:
InChI=1S/C12H19NO2/c1-14-12(15-2)9-6-10-13-11-7-4-3-5-8-11/h3-5,7-8,12-13H,6,9-10H2,1-2H3
InChI Key:
RLLHJLZSFJTADT-UHFFFAOYSA-N
SMILES:
COC(CCCNc1ccccc1)OC
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.142g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.289g/mol
Monoisotopic Mass:
209.142g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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