Home Other Building Blocks 2,2,2-trifluoroethyl N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)carbamate

2,2,2-trifluoroethyl N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)carbamate

CAS No.:
1479623-29-4
Catalog Number:
AG019Y14
Molecular Formula:
C10H11F3N2O2S
Molecular Weight:
280.2667
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Product Description
Catalog Number:
AG019Y14
Chemical Name:
2,2,2-trifluoroethyl N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)carbamate
CAS Number:
1479623-29-4
Molecular Formula:
C10H11F3N2O2S
Molecular Weight:
280.2667
MDL Number:
MFCD20762545
IUPAC Name:
2,2,2-trifluoroethyl N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)carbamate
InChI:
InChI=1S/C10H11F3N2O2S/c11-10(12,13)5-17-9(16)15-8-14-6-3-1-2-4-7(6)18-8/h1-5H2,(H,14,15,16)
InChI Key:
SDIIGQNLKNLRIM-UHFFFAOYSA-N
SMILES:
O=C(Nc1nc2c(s1)CCCC2)OCC(F)(F)F
Properties
Complexity:
314  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.049g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
280.265g/mol
Monoisotopic Mass:
280.049g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties