Home Carboxys ethyl 4-(trifluoromethyl)piperidine-4-carboxylate

ethyl 4-(trifluoromethyl)piperidine-4-carboxylate

CAS No.:
1211592-31-2
Catalog Number:
AG01EMVJ
Molecular Formula:
C9H14F3NO2
Molecular Weight:
225.2082
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Product Description
Catalog Number:
AG01EMVJ
Chemical Name:
ethyl 4-(trifluoromethyl)piperidine-4-carboxylate
CAS Number:
1211592-31-2
Molecular Formula:
C9H14F3NO2
Molecular Weight:
225.2082
MDL Number:
MFCD28969494
IUPAC Name:
ethyl 4-(trifluoromethyl)piperidine-4-carboxylate
InChI:
InChI=1S/C9H14F3NO2/c1-2-15-7(14)8(9(10,11)12)3-5-13-6-4-8/h13H,2-6H2,1H3
InChI Key:
AHRBNYBJXZIZAI-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1(CCNCC1)C(F)(F)F
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.098g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.211g/mol
Monoisotopic Mass:
225.098g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties