Home Aminos ethyl 2-[(3-amino-1,1,1-trifluoropropan-2-yl)sulfanyl]acetate hydrochloride

ethyl 2-[(3-amino-1,1,1-trifluoropropan-2-yl)sulfanyl]acetate hydrochloride

CAS No.:
2060008-56-0
Catalog Number:
AG01BS72
Molecular Formula:
C7H13ClF3NO2S
Molecular Weight:
267.6968
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Product Description
Catalog Number:
AG01BS72
Chemical Name:
ethyl 2-[(3-amino-1,1,1-trifluoropropan-2-yl)sulfanyl]acetate hydrochloride
CAS Number:
2060008-56-0
Molecular Formula:
C7H13ClF3NO2S
Molecular Weight:
267.6968
MDL Number:
MFCD30536079
IUPAC Name:
ethyl 2-(3-amino-1,1,1-trifluoropropan-2-yl)sulfanylacetate;hydrochloride
InChI:
InChI=1S/C7H12F3NO2S.ClH/c1-2-13-6(12)4-14-5(3-11)7(8,9)10;/h5H,2-4,11H2,1H3;1H
InChI Key:
LZBVCQPBBHUQNC-UHFFFAOYSA-N
SMILES:
CCOC(=O)CSC(C(F)(F)F)CN.Cl
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.031g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
267.691g/mol
Monoisotopic Mass:
267.031g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
77.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties