Name: Name:2,2,2-trifluoroethyl N-(4-methyl-3-{[(2,2,2-trifluoroethoxy)carbonyl]amino}phenyl)carbamate
Brand: Angene
SKU: AG019KC6
Rating: 90 (10 reviews)

2,2,2-trifluoroethyl N-(4-methyl-3-{[(2,2,2-trifluoroethoxy)carbonyl]amino}phenyl)carbamate

CAS No.:

216142-84-6

Catalog Number:

AG019KC6

Molecular Formula:

C13H12F6N2O4

Molecular Weight:

374.2358

Catalog Number:

AG019KC6

Chemical Name:

2,2,2-trifluoroethyl N-(4-methyl-3-{[(2,2,2-trifluoroethoxy)carbonyl]amino}phenyl)carbamate

CAS Number:

216142-84-6

Molecular Formula:

C13H12F6N2O4

Molecular Weight:

374.2358

MDL Number:

MFCD00380032

IUPAC Name:

2,2,2-trifluoroethyl N-[2-methyl-5-(2,2,2-trifluoroethoxycarbonylamino)phenyl]carbamate

InChI:

InChI=1S/C13H12F6N2O4/c1-7-2-3-8(20-10(22)24-5-12(14,15)16)4-9(7)21-11(23)25-6-13(17,18)19/h2-4H,5-6H2,1H3,(H,20,22)(H,21,23)

InChI Key:

NFCSOMUIDKOUFP-UHFFFAOYSA-N

SMILES:

O=C(Nc1ccc(c(c1)NC(=O)OCC(F)(F)F)C)OCC(F)(F)F

NSC Number:

205593

Complexity:

468

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

374.07g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

374.239g/mol

Monoisotopic Mass:

374.07g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

76.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4