Home Aminos 3-[cyclopropyl(methyl)amino]-4,4,4-trifluorobutanoic acid

3-[cyclopropyl(methyl)amino]-4,4,4-trifluorobutanoic acid

CAS No.:
1341824-98-3
Catalog Number:
AG01EKAI
Molecular Formula:
C8H12F3NO2
Molecular Weight:
211.1816
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Product Description
Catalog Number:
AG01EKAI
Chemical Name:
3-[cyclopropyl(methyl)amino]-4,4,4-trifluorobutanoic acid
CAS Number:
1341824-98-3
Molecular Formula:
C8H12F3NO2
Molecular Weight:
211.1816
MDL Number:
MFCD17286806
IUPAC Name:
3-[cyclopropyl(methyl)amino]-4,4,4-trifluorobutanoic acid
InChI:
InChI=1S/C8H12F3NO2/c1-12(5-2-3-5)6(4-7(13)14)8(9,10)11/h5-6H,2-4H2,1H3,(H,13,14)
InChI Key:
CKXAYTDMSFZWEN-UHFFFAOYSA-N
SMILES:
CN(C(C(F)(F)F)CC(=O)O)C1CC1
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.082g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.184g/mol
Monoisotopic Mass:
211.082g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties