Products 1807791-77-0

CAS 1807791-77-0 appears in our catalog under these names: 3-[(2S)-6-[(E)-2-[2-Chloro-6-(trifluoromethyl)phenyl]ethenyl]-4-[3-(trifluoromethyl)benzenesulfonyl]-3,4-dihydro-2h-1,4-benzoxazin-2-yl]propanoic acid, 95%, 3-[(2S)-6-[(E)-2-[2-CHLORO-6-(TRIFLUOROMETHYL)PHENYL]ETHENYL]-4-[3-(TRIFLUOROMETHYL)BENZENESULFONYL]-3,4-DIHYDRO-2H-1,4-BENZOXAZIN-2-YL]PROPANOIC ACID, 97%. Offered by: Combi-blocks, Fluorochem, Chemat. Available pack sizes: 1g, 100mg, 250mg, 500mg.

Structural formula: {0} (CAS {1})

3-[(2S)-6-[(E)-2-[2-chloro-6-(trifluoromethyl)phenyl]ethenyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]propanoic acid (CAS 1807791-77-0) is a chemical compound with the molecular formula C27H20ClF6NO5S and a molecular weight of 620.0 g/mol. IUPAC name: 3-[(2S)-6-[(E)-2-[2-chloro-6-(trifluoromethyl)phenyl]ethenyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]propanoic acid. InChIKey: HNQAJIBKSKZNTO-HKMNZKMDSA-N.

Identity
Molecular formulaC27H20ClF6NO5S
Molecular weight620.0 g/mol
IUPAC name3-[(2S)-6-[(E)-2-[2-chloro-6-(trifluoromethyl)phenyl]ethenyl]-4-[3-(trifluoromethyl)phenyl]sulfonyl-2,3-dihydro-1,4-benzoxazin-2-yl]propanoic acid
InChIKeyHNQAJIBKSKZNTO-HKMNZKMDSA-N
SMILESC1[C@@H](OC2=C(N1S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C=C(C=C2)/C=C/C4=C(C=CC=C4Cl)C(F)(F)F)CCC(=O)O

Computed by PubChem (NCBI)