Home Aminos 2-amino-5-methoxy-2-(trifluoromethyl)pentanoic acid

2-amino-5-methoxy-2-(trifluoromethyl)pentanoic acid

CAS No.:
1803561-31-0
Catalog Number:
AG01A46Q
Molecular Formula:
C7H12F3NO3
Molecular Weight:
215.1703
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Product Description
Catalog Number:
AG01A46Q
Chemical Name:
2-amino-5-methoxy-2-(trifluoromethyl)pentanoic acid
CAS Number:
1803561-31-0
Molecular Formula:
C7H12F3NO3
Molecular Weight:
215.1703
MDL Number:
MFCD27980622
IUPAC Name:
2-amino-5-methoxy-2-(trifluoromethyl)pentanoic acid
InChI:
InChI=1S/C7H12F3NO3/c1-14-4-2-3-6(11,5(12)13)7(8,9)10/h2-4,11H2,1H3,(H,12,13)
InChI Key:
QBZLPKGOELPOHB-UHFFFAOYSA-N
SMILES:
COCCCC(C(F)(F)F)(C(=O)O)N
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.077g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
215.172g/mol
Monoisotopic Mass:
215.077g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.9  
Properties