Home Other Building Blocks 3-(3-methylbutoxy)aniline

3-(3-methylbutoxy)aniline

CAS No.:
17258-52-5
Catalog Number:
AG019XPI
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
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Product Description
Catalog Number:
AG019XPI
Chemical Name:
3-(3-methylbutoxy)aniline
CAS Number:
17258-52-5
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
MDL Number:
MFCD06800852
IUPAC Name:
3-(3-methylbutoxy)aniline
InChI:
InChI=1S/C11H17NO/c1-9(2)6-7-13-11-5-3-4-10(12)8-11/h3-5,8-9H,6-7,12H2,1-2H3
InChI Key:
HIZQGOGXVNCCEG-UHFFFAOYSA-N
SMILES:
CC(CCOc1cccc(c1)N)C
Properties
Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.131g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
179.263g/mol
Monoisotopic Mass:
179.131g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties