Home Other Building Blocks 1-(4-butoxyphenyl)ethanamine

1-(4-butoxyphenyl)ethanamine

CAS No.:
91553-11-6
Catalog Number:
AG01DWUC
Molecular Formula:
C12H19NO
Molecular Weight:
193.2854
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Product Description
Catalog Number:
AG01DWUC
Chemical Name:
1-(4-butoxyphenyl)ethanamine
CAS Number:
91553-11-6
Molecular Formula:
C12H19NO
Molecular Weight:
193.2854
MDL Number:
MFCD01732571
IUPAC Name:
1-(4-butoxyphenyl)ethanamine
InChI:
InChI=1S/C12H19NO/c1-3-4-9-14-12-7-5-11(6-8-12)10(2)13/h5-8,10H,3-4,9,13H2,1-2H3
InChI Key:
ANOJLHQGMTVKNE-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1)C(N)C
Properties
Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.147g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.29g/mol
Monoisotopic Mass:
193.147g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties