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159539-53-4

159539-53-4 | Benzenamine, 2,5-bis(hexyloxy)-

CAS No: 159539-53-4 Catalog No: AG001R5Z MDL No:

Product Description

Catalog Number:
AG001R5Z
Chemical Name:
Benzenamine, 2,5-bis(hexyloxy)-
CAS Number:
159539-53-4
Molecular Formula:
C18H31NO2
Molecular Weight:
293.4442
IUPAC Name:
2,5-dihexoxyaniline
InChI:
InChI=1S/C18H31NO2/c1-3-5-7-9-13-20-16-11-12-18(17(19)15-16)21-14-10-8-6-4-2/h11-12,15H,3-10,13-14,19H2,1-2H3
InChI Key:
YADACKYMINHBDB-UHFFFAOYSA-N
SMILES:
CCCCCCOc1ccc(c(c1)N)OCCCCCC

Properties

Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.235g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
293.451g/mol
Monoisotopic Mass:
293.235g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9  

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