Home Aminos 2-(benzylamino)-1-(3-methoxyphenyl)ethan-1-ol

2-(benzylamino)-1-(3-methoxyphenyl)ethan-1-ol

CAS No.:
91578-93-7
Catalog Number:
AG01A0IC
Molecular Formula:
C16H19NO2
Molecular Weight:
257.3276
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Product Description
Catalog Number:
AG01A0IC
Chemical Name:
2-(benzylamino)-1-(3-methoxyphenyl)ethan-1-ol
CAS Number:
91578-93-7
Molecular Formula:
C16H19NO2
Molecular Weight:
257.3276
MDL Number:
MFCD11923842
IUPAC Name:
2-(benzylamino)-1-(3-methoxyphenyl)ethanol
InChI:
InChI=1S/C16H19NO2/c1-19-15-9-5-8-14(10-15)16(18)12-17-11-13-6-3-2-4-7-13/h2-10,16-18H,11-12H2,1H3
InChI Key:
MJTYNPILNLIVAJ-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)C(CNCc1ccccc1)O
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.142g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
257.333g/mol
Monoisotopic Mass:
257.142g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties