Home Other Building Blocks 2,2,2-trifluoroethyl N-pentylcarbamate

2,2,2-trifluoroethyl N-pentylcarbamate

CAS No.:
201487-93-6
Catalog Number:
AG019XWH
Molecular Formula:
C8H14F3NO2
Molecular Weight:
213.1975
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Product Description
Catalog Number:
AG019XWH
Chemical Name:
2,2,2-trifluoroethyl N-pentylcarbamate
CAS Number:
201487-93-6
Molecular Formula:
C8H14F3NO2
Molecular Weight:
213.1975
MDL Number:
MFCD13368231
IUPAC Name:
2,2,2-trifluoroethyl N-pentylcarbamate
InChI:
InChI=1S/C8H14F3NO2/c1-2-3-4-5-12-7(13)14-6-8(9,10)11/h2-6H2,1H3,(H,12,13)
InChI Key:
LKXHYLJLWMAHHQ-UHFFFAOYSA-N
SMILES:
CCCCCNC(=O)OCC(F)(F)F
Properties
Complexity:
171  
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:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.2g/mol
Monoisotopic Mass:
213.098g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties