Home Other Building Blocks 2,2,2-trifluoroethyl N-(3,5-dimethyl-1H-pyrazol-4-yl)carbamate

2,2,2-trifluoroethyl N-(3,5-dimethyl-1H-pyrazol-4-yl)carbamate

CAS No.:
1187446-51-0
Catalog Number:
AG01AGZC
Molecular Formula:
C8H10F3N3O2
Molecular Weight:
237.1791
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Product Description
Catalog Number:
AG01AGZC
Chemical Name:
2,2,2-trifluoroethyl N-(3,5-dimethyl-1H-pyrazol-4-yl)carbamate
CAS Number:
1187446-51-0
Molecular Formula:
C8H10F3N3O2
Molecular Weight:
237.1791
MDL Number:
MFCD12135582
IUPAC Name:
2,2,2-trifluoroethyl N-(3,5-dimethyl-1H-pyrazol-4-yl)carbamate
InChI:
InChI=1S/C8H10F3N3O2/c1-4-6(5(2)14-13-4)12-7(15)16-3-8(9,10)11/h3H2,1-2H3,(H,12,15)(H,13,14)
InChI Key:
FMWVFGOHIHSJNX-UHFFFAOYSA-N
SMILES:
O=C(Nc1c(C)n[nH]c1C)OCC(F)(F)F
Properties
Complexity:
259  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.073g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
237.182g/mol
Monoisotopic Mass:
237.073g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties