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1040688-35-4 | N-{2-[2
CAS No: 1040688-35-4 Catalog No: AG01FOD8 MDL No:
Product Description
Catalog Number:
AG01FOD8
Chemical Name:
N-{2-[2
CAS Number:
1040688-35-4
IUPAC Name:
N-[2-(2,4-ditert-butylphenoxy)ethyl]-4-(2-methylpropoxy)aniline
InChI:
InChI=1S/C26H39NO2/c1-19(2)18-29-22-12-10-21(11-13-22)27-15-16-28-24-14-9-20(25(3,4)5)17-23(24)26(6,7)8/h9-14,17,19,27H,15-16,18H2,1-8H3
InChI Key:
LGNVRVRBFBHFKN-UHFFFAOYSA-N
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
397.298g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
397.603g/mol
Monoisotopic Mass:
397.298g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.2
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