Home Other Building Blocks 2,2,2-trifluoroethyl N-(3,5-difluorophenyl)carbamate

2,2,2-trifluoroethyl N-(3,5-difluorophenyl)carbamate

CAS No.:
1087798-37-5
Catalog Number:
AG019QVI
Molecular Formula:
C9H6F5NO2
Molecular Weight:
255.1415
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Product Description
Catalog Number:
AG019QVI
Chemical Name:
2,2,2-trifluoroethyl N-(3,5-difluorophenyl)carbamate
CAS Number:
1087798-37-5
Molecular Formula:
C9H6F5NO2
Molecular Weight:
255.1415
MDL Number:
MFCD11099874
IUPAC Name:
2,2,2-trifluoroethyl N-(3,5-difluorophenyl)carbamate
InChI:
InChI=1S/C9H6F5NO2/c10-5-1-6(11)3-7(2-5)15-8(16)17-4-9(12,13)14/h1-3H,4H2,(H,15,16)
InChI Key:
VEJZYQJNWQBTQG-UHFFFAOYSA-N
SMILES:
O=C(Nc1cc(F)cc(c1)F)OCC(F)(F)F
Properties
Complexity:
261  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.032g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
255.144g/mol
Monoisotopic Mass:
255.032g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties