Home Other Building Blocks 3-{[(2-ethylhexyl)oxy]methyl}aniline

3-{[(2-ethylhexyl)oxy]methyl}aniline

CAS No.:
1039311-50-6
Catalog Number:
AG019XXA
Molecular Formula:
C15H25NO
Molecular Weight:
235.3651
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Product Description
Catalog Number:
AG019XXA
Chemical Name:
3-{[(2-ethylhexyl)oxy]methyl}aniline
CAS Number:
1039311-50-6
Molecular Formula:
C15H25NO
Molecular Weight:
235.3651
MDL Number:
MFCD11196360
IUPAC Name:
3-(2-ethylhexoxymethyl)aniline
InChI:
InChI=1S/C15H25NO/c1-3-5-7-13(4-2)11-17-12-14-8-6-9-15(16)10-14/h6,8-10,13H,3-5,7,11-12,16H2,1-2H3
InChI Key:
NNDQLCOUJBVGNL-UHFFFAOYSA-N
SMILES:
CCCCC(COCc1cccc(c1)N)CC
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.194g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.371g/mol
Monoisotopic Mass:
235.194g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties