Name: Name:Carbamic acid, (3-chlorophenyl)-, 2,2,2-trifluoroethyl ester (9CI)
Brand: Angene
SKU: AG002O2P
Rating: 90 (10 reviews)

Carbamic acid, (3-chlorophenyl)-, 2,2,2-trifluoroethyl ester (9CI)

CAS No.:

2366-82-7

Catalog Number:

AG002O2P

Molecular Formula:

C9H7ClF3NO2

Molecular Weight:

253.6056

Catalog Number:

AG002O2P

Chemical Name:

Carbamic acid, (3-chlorophenyl)-, 2,2,2-trifluoroethyl ester (9CI)

CAS Number:

2366-82-7

Molecular Formula:

C9H7ClF3NO2

Molecular Weight:

253.6056

MDL Number:

MFCD00454052

IUPAC Name:

2,2,2-trifluoroethyl N-(3-chlorophenyl)carbamate

InChI:

InChI=1S/C9H7ClF3NO2/c10-6-2-1-3-7(4-6)14-8(15)16-5-9(11,12)13/h1-4H,5H2,(H,14,15)

InChI Key:

TYSCZMZABCQYNK-UHFFFAOYSA-N

SMILES:

O=C(Nc1cccc(c1)Cl)OCC(F)(F)F

Complexity:

247

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

253.012g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

253.605g/mol

Monoisotopic Mass:

253.012g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

38.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.7