Home Aminos (2S)-3-[(3,3,3-trifluoropropyl)amino]propane-1,2-diol

(2S)-3-[(3,3,3-trifluoropropyl)amino]propane-1,2-diol

CAS No.:
1344922-37-7
Catalog Number:
AG019Z0P
Molecular Formula:
C6H12F3NO2
Molecular Weight:
187.1602
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Product Description
Catalog Number:
AG019Z0P
Chemical Name:
(2S)-3-[(3,3,3-trifluoropropyl)amino]propane-1,2-diol
CAS Number:
1344922-37-7
Molecular Formula:
C6H12F3NO2
Molecular Weight:
187.1602
MDL Number:
MFCD18298113
IUPAC Name:
(2S)-3-(3,3,3-trifluoropropylamino)propane-1,2-diol
InChI:
InChI=1S/C6H12F3NO2/c7-6(8,9)1-2-10-3-5(12)4-11/h5,10-12H,1-4H2/t5-/m0/s1
InChI Key:
XVHRUYSKNBDAKC-YFKPBYRVSA-N
SMILES:
OC[C@H](CNCCC(F)(F)F)O
Properties
Complexity:
118  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
187.082g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
187.162g/mol
Monoisotopic Mass:
187.082g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties