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1263376-64-2 | Ethyl 2-Amino-2-trifluoromethyl-pentanoate
CAS No: 1263376-64-2 Catalog No: AG01FB7R MDL No:
Product Description
Catalog Number:
AG01FB7R
Chemical Name:
Ethyl 2-Amino-2-trifluoromethyl-pentanoate
CAS Number:
1263376-64-2
Molecular Formula:
C7H12F3NO2
Molecular Weight:
199.1709
IUPAC Name:
ethyl 2-amino-2-(trifluoromethyl)pentanoate
InChI:
InChI=1S/C8H14F3NO2/c1-3-5-7(12,8(9,10)11)6(13)14-4-2/h3-5,12H2,1-2H3
InChI Key:
JMJKDVFYCJGJKK-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C(F)(F)F)(CC)N
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.098g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.2g/mol
Monoisotopic Mass:
213.098g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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