Name: Name:2,2,2-trifluoroethyl N-(2-chloro-4-nitrophenyl)carbamate
Brand: Angene
SKU: AG019XJX
Rating: 90 (10 reviews)

2,2,2-trifluoroethyl N-(2-chloro-4-nitrophenyl)carbamate

CAS No.:

1235439-39-0

Catalog Number:

AG019XJX

Molecular Formula:

C9H6ClF3N2O4

Molecular Weight:

298.6031

Catalog Number:

AG019XJX

Chemical Name:

2,2,2-trifluoroethyl N-(2-chloro-4-nitrophenyl)carbamate

CAS Number:

1235439-39-0

Molecular Formula:

C9H6ClF3N2O4

Molecular Weight:

298.6031

MDL Number:

MFCD16039985

IUPAC Name:

2,2,2-trifluoroethyl N-(2-chloro-4-nitrophenyl)carbamate

InChI:

InChI=1S/C9H6ClF3N2O4/c10-6-3-5(15(17)18)1-2-7(6)14-8(16)19-4-9(11,12)13/h1-3H,4H2,(H,14,16)

InChI Key:

OYRSBPWZLVBSIW-UHFFFAOYSA-N

SMILES:

O=C(Nc1ccc(cc1Cl)[N+](=O)[O-])OCC(F)(F)F

Complexity:

347

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

297.997g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

298.602g/mol

Monoisotopic Mass:

297.997g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

84.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9