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125662-99-9 | 1,2-Benzenediamine, 4,5-bis(tetradecyloxy)-
CAS No: 125662-99-9 Catalog No: AG000OAK MDL No:
Product Description
Catalog Number:
AG000OAK
Chemical Name:
1,2-Benzenediamine, 4,5-bis(tetradecyloxy)-
CAS Number:
125662-99-9
Molecular Formula:
C34H64N2O2
Molecular Weight:
532.8842
IUPAC Name:
4,5-di(tetradecoxy)benzene-1,2-diamine
InChI:
InChI=1S/C34H64N2O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-37-33-29-31(35)32(36)30-34(33)38-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29-30H,3-28,35-36H2,1-2H3
InChI Key:
HONNUQDHRZSHOQ-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCOc1cc(N)c(cc1OCCCCCCCCCCCCCC)N
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
532.497g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
532.898g/mol
Monoisotopic Mass:
532.497g/mol
Rotatable Bond Count:
28
Topological Polar Surface Area:
70.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
13.8
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