Home Aminos 1-(4-aminobutoxy)-4-methylbenzene

1-(4-aminobutoxy)-4-methylbenzene

CAS No.:
75716-46-0
Catalog Number:
AG019UO4
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
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Product Description
Catalog Number:
AG019UO4
Chemical Name:
1-(4-aminobutoxy)-4-methylbenzene
CAS Number:
75716-46-0
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
MDL Number:
MFCD09807731
IUPAC Name:
4-(4-methylphenoxy)butan-1-amine
InChI:
InChI=1S/C11H17NO/c1-10-4-6-11(7-5-10)13-9-3-2-8-12/h4-7H,2-3,8-9,12H2,1H3
InChI Key:
NCAJSWHJILCMSV-UHFFFAOYSA-N
SMILES:
NCCCCOc1ccc(cc1)C
Properties
Complexity:
119  
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:
5  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties