Home Aminos methyl 5-amino-4-(trifluoromethyl)pentanoate hydrochloride

methyl 5-amino-4-(trifluoromethyl)pentanoate hydrochloride

CAS No.:
911634-66-7
Catalog Number:
AG01EJP8
Molecular Formula:
C7H13ClF3NO2
Molecular Weight:
235.6318
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Product Description
Catalog Number:
AG01EJP8
Chemical Name:
methyl 5-amino-4-(trifluoromethyl)pentanoate hydrochloride
CAS Number:
911634-66-7
Molecular Formula:
C7H13ClF3NO2
Molecular Weight:
235.6318
MDL Number:
MFCD31616424
IUPAC Name:
methyl 4-(aminomethyl)-5,5,5-trifluoropentanoate;hydrochloride
InChI:
InChI=1S/C7H12F3NO2.ClH/c1-13-6(12)3-2-5(4-11)7(8,9)10;/h5H,2-4,11H2,1H3;1H
InChI Key:
GKRPURFPTFWNBW-UHFFFAOYSA-N
SMILES:
NCC(C(F)(F)F)CCC(=O)OC.Cl
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.059g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
235.631g/mol
Monoisotopic Mass:
235.059g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties