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303104-20-3 | Benzenemethanamine, N,N'-[1,2-ethanediylbis(oxy-2,1-ethanediyl)]bis[α,α-diphenyl- (9CI)
CAS No: 303104-20-3 Catalog No: AG002ZN5 MDL No:
Product Description
Catalog Number:
AG002ZN5
Chemical Name:
Benzenemethanamine, N,N'-[1,2-ethanediylbis(oxy-2,1-ethanediyl)]bis[α,α-diphenyl- (9CI)
CAS Number:
303104-20-3
Molecular Formula:
C44H44N2O2
Molecular Weight:
632.8324
IUPAC Name:
N-trityl-2-[2-[2-(tritylamino)ethoxy]ethoxy]ethanamine
InChI:
InChI=1S/C44H44N2O2/c1-7-19-37(20-8-1)43(38-21-9-2-10-22-38,39-23-11-3-12-24-39)45-31-33-47-35-36-48-34-32-46-44(40-25-13-4-14-26-40,41-27-15-5-16-28-41)42-29-17-6-18-30-42/h1-30,45-46H,31-36H2
InChI Key:
IJRHQBAXGORRJF-UHFFFAOYSA-N
SMILES:
O(CCNC(c1ccccc1)(c1ccccc1)c1ccccc1)CCOCCNC(c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
681
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
632.34g/mol
Formal Charge:
0
Heavy Atom Count:
48
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
632.848g/mol
Monoisotopic Mass:
632.34g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.4
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