Name: Name:2-Bromo-2'-nitro-4'-(trifluoromethyl)diphenyl ether
Brand: Angene
SKU: AG002IRC
Rating: 90 (10 reviews)

2-Bromo-2'-nitro-4'-(trifluoromethyl)diphenyl ether

CAS No.:

2069-14-9

Catalog Number:

AG002IRC

Molecular Formula:

C13H7BrF3NO3

Molecular Weight:

362.0988

Catalog Number:

AG002IRC

Chemical Name:

2-Bromo-2'-nitro-4'-(trifluoromethyl)diphenyl ether

CAS Number:

2069-14-9

Molecular Formula:

C13H7BrF3NO3

Molecular Weight:

362.0988

MDL Number:

MFCD00069136

IUPAC Name:

1-(2-bromophenoxy)-2-nitro-4-(trifluoromethyl)benzene

InChI:

InChI=1S/C13H7BrF3NO3/c14-9-3-1-2-4-11(9)21-12-6-5-8(13(15,16)17)7-10(12)18(19)20/h1-7H

InChI Key:

MEJCOJYNRIVQRG-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1cc(ccc1Oc1ccccc1Br)C(F)(F)F

Complexity:

375

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

360.956g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

362.102g/mol

Monoisotopic Mass:

360.956g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.5