Name: Name:6-bromo-8-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzoxazine
Brand: Angene
SKU: AG01C5G7
Rating: 90 (10 reviews)

6-bromo-8-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzoxazine

CAS No.:

1909313-53-6

Catalog Number:

AG01C5G7

Molecular Formula:

C9H7BrF3NO

Molecular Weight:

282.0572

Catalog Number:

AG01C5G7

Chemical Name:

6-bromo-8-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzoxazine

CAS Number:

1909313-53-6

Molecular Formula:

C9H7BrF3NO

Molecular Weight:

282.0572

MDL Number:

MFCD29907076

IUPAC Name:

6-bromo-8-(trifluoromethyl)-3,4-dihydro-2H-1,4-benzoxazine

InChI:

InChI=1S/C9H7BrF3NO/c10-5-3-6(9(11,12)13)8-7(4-5)14-1-2-15-8/h3-4,14H,1-2H2

InChI Key:

KCHMSPNPXJRRCR-UHFFFAOYSA-N

SMILES:

Brc1cc2NCCOc2c(c1)C(F)(F)F

Complexity:

236

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

280.966g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

282.06g/mol

Monoisotopic Mass:

280.966g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

21.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2