Name: Name:Benzene, 1-chloro-2-fluoro-3-nitro-5-(trifluoromethyl)-
Brand: Angene
SKU: AG00050H
Rating: 90 (10 reviews)

Benzene, 1-chloro-2-fluoro-3-nitro-5-(trifluoromethyl)-

CAS No.:

101646-02-0

Catalog Number:

AG00050H

Molecular Formula:

C7H2ClF4NO2

Molecular Weight:

243.5429

Catalog Number:

AG00050H

Chemical Name:

Benzene, 1-chloro-2-fluoro-3-nitro-5-(trifluoromethyl)-

CAS Number:

101646-02-0

Molecular Formula:

C7H2ClF4NO2

Molecular Weight:

243.5429

MDL Number:

MFCD00871861

IUPAC Name:

1-chloro-2-fluoro-3-nitro-5-(trifluoromethyl)benzene

InChI:

InChI=1S/C7H2ClF4NO2/c8-4-1-3(7(10,11)12)2-5(6(4)9)13(14)15/h1-2H

InChI Key:

JVOKKJHIEVEFEB-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1cc(cc(c1F)Cl)C(F)(F)F

Complexity:

254

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

242.971g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

243.542g/mol

Monoisotopic Mass:

242.971g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

45.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4