Home Aminos 2-(benzylamino)-3,3,3-trifluoropropan-1-ol

2-(benzylamino)-3,3,3-trifluoropropan-1-ol

CAS No.:
126536-03-6
Catalog Number:
AG01AK34
Molecular Formula:
C10H12F3NO
Molecular Weight:
219.2036
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Product Description
Catalog Number:
AG01AK34
Chemical Name:
2-(benzylamino)-3,3,3-trifluoropropan-1-ol
CAS Number:
126536-03-6
Molecular Formula:
C10H12F3NO
Molecular Weight:
219.2036
MDL Number:
MFCD19686511
IUPAC Name:
2-(benzylamino)-3,3,3-trifluoropropan-1-ol
InChI:
InChI=1S/C10H12F3NO/c11-10(12,13)9(7-15)14-6-8-4-2-1-3-5-8/h1-5,9,14-15H,6-7H2
InChI Key:
QLSSMBHEKYVHFV-UHFFFAOYSA-N
SMILES:
OCC(C(F)(F)F)NCc1ccccc1
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.087g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
219.207g/mol
Monoisotopic Mass:
219.087g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties