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1300712-89-3 | Ethyl 2-Amino-4-methyl-2-trifluoromethyl-hexanoate
CAS No: 1300712-89-3 Catalog No: AG01F8ZE MDL No:
Product Description
Catalog Number:
AG01F8ZE
Chemical Name:
Ethyl 2-Amino-4-methyl-2-trifluoromethyl-hexanoate
CAS Number:
1300712-89-3
Molecular Formula:
C10H18F3NO2
Molecular Weight:
241.2506
IUPAC Name:
ethyl 2-amino-4-methyl-2-(trifluoromethyl)hexanoate
InChI:
InChI=1S/C10H18F3NO2/c1-4-7(3)6-9(14,10(11,12)13)8(15)16-5-2/h7H,4-6,14H2,1-3H3
InChI Key:
BATGPFDQRBHGKB-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C(F)(F)F)(CC(CC)C)N
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.129g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.254g/mol
Monoisotopic Mass:
241.129g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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