Home Aminos 4-amino-3-(trifluoromethyl)butanoic acid hydrochloride

4-amino-3-(trifluoromethyl)butanoic acid hydrochloride

CAS No.:
1803598-91-5
Catalog Number:
AG01BAPH
Molecular Formula:
C5H9ClF3NO2
Molecular Weight:
207.5787
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Product Description
Catalog Number:
AG01BAPH
Chemical Name:
4-amino-3-(trifluoromethyl)butanoic acid hydrochloride
CAS Number:
1803598-91-5
Molecular Formula:
C5H9ClF3NO2
Molecular Weight:
207.5787
MDL Number:
MFCD28397711
IUPAC Name:
3-(aminomethyl)-4,4,4-trifluorobutanoic acid;hydrochloride
InChI:
InChI=1S/C5H8F3NO2.ClH/c6-5(7,8)3(2-9)1-4(10)11;/h3H,1-2,9H2,(H,10,11);1H
InChI Key:
XRJPLXZCPPGEIE-UHFFFAOYSA-N
SMILES:
NCC(C(F)(F)F)CC(=O)O.Cl
Properties
Complexity:
145  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.027g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
207.577g/mol
Monoisotopic Mass:
207.027g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties