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102207-78-3 | 2-Pyrimidinamine, 4-[2-(dioctylamino)ethoxy]-
CAS No: 102207-78-3 Catalog No: AG0006XH MDL No:
Product Description
Catalog Number:
AG0006XH
Chemical Name:
2-Pyrimidinamine, 4-[2-(dioctylamino)ethoxy]-
CAS Number:
102207-78-3
Molecular Formula:
C22H42N4O
Molecular Weight:
378.5951
IUPAC Name:
4-[2-(dioctylamino)ethoxy]pyrimidin-2-amine
InChI:
InChI=1S/C22H42N4O/c1-3-5-7-9-11-13-17-26(18-14-12-10-8-6-4-2)19-20-27-21-15-16-24-22(23)25-21/h15-16H,3-14,17-20H2,1-2H3,(H2,23,24,25)
InChI Key:
AXJIPCUJIFBEBX-UHFFFAOYSA-N
SMILES:
CCCCCCCCN(CCOc1ccnc(n1)N)CCCCCCCC
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.336g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
378.605g/mol
Monoisotopic Mass:
378.336g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7
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