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Substance Name: 7-Chloro-6-fluoro-4-hydroxy-2-methylchroman-4-acetic acid
RN: 111477-47-5
UNII: 7BB546DQ6H
InChIKey: BRXHBAFNICPNFH-SREIQFSDSA-N

Molecular Formula

  • C12-H12-Cl-F-O4

Molecular Weight

  • 274.6738
 
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Names and Synonyms

Name of Substance

  • 7-Chloro-6-fluoro-4-hydroxy-2-methylchroman-4-acetic acid

Synonyms

  • 7-Chloro-6-fluoro-3,4-dihydro-4-hydroxy-2-methyl-2H-1-benzopyran-4-acetic acid (2R-cis)-
  • 7-Cl-6-F-HMCA
  • UNII-7BB546DQ6H

Systematic Name

  • 2H-1-Benzopyran-4-acetic acid, 7-chloro-6-fluoro-3,4-dihydro-4-hydroxy-2-methyl-, (2R-cis)-

Registry Numbers

CAS Registry Number

  • 111477-47-5

FDA UNII

  • 7BB546DQ6H

System Generated Number

  • 0111477475

Structure Descriptors

InChI

1S/C12H12ClFO4/c1-6-4-12(17,5-11(15)16)7-2-9(14)8(13)3-10(7)18-6/h2-3,6,17H,4-5H2,1H3,(H,15,16)/t6-,12-/m1/s1

InChIKey

BRXHBAFNICPNFH-SREIQFSDSA-N

Smiles

C[C@@H]1C[C@](c2cc(c(cc2O1)Cl)F)(CC(=O)O)O