3-(5-CHLORO-2-BENZOXAZOLYL)-4-CYANOUMBELLIFERONE

CAS No.
97477-81-1
CCD No.
CCD00152630
Formula
C17 H7 Cl N2 O4
MolWeight
338.705

Basic Information

Product Name: 3-(5-CHLORO-2-BENZOXAZOLYL)-4-CYANOUMBELLIFERONE
CAS: 97477-81-1
English Synonyms: 3-(5-CHLORO-2-BENZOXAZOLYL)-4-CYANO-7-HYDROXYCOUMARIN ; 3-(5-CHLORO-BENZOOXAZOL-2-YL)-7-HYDROXY-2-OXO-2H-CHROMENE-4-CARBONITRILE ; 3-(5-CHLORO-2-BENZOXAZOLYL)-4-CYANOUMBELLIFERONE
MDL Number.: MFCD00674504
H bond acceptor: 6
H bond donor: 1
Smile: c1cc2c(cc1O)oc(=O)c(c2C#N)c3nc4cc(ccc4o3)Cl
InChi: InChI=1S/C17H7ClN2O4/c18-8-1-4-13-12(5-8)20-16(23-13)15-11(7-19)10-3-2-9(21)6-14(10)24-17(15)22/h1-6,21H
InChiKey: InChIKey=MEQPFAHGQRHYMD-UHFFFAOYSA-N

Property

Melting Point: 291-294 DEG C(LIT)
Comments: APPLICATION: SUITABLE AS PH-INDICATOR
ASSAY METHOD: TLC
FLUORESCENCE: LAMBDAEM 577 NM IN 0.1 M TRIS PH 9.0
FLUORESCENCE: LAMBDAEX 497 NM
FOR FLUORESCENCE
OTHER NOTES: LONGWAVE ABSORBING AND FLUORESCING PH INDICATOR, AND ENZYME SUBSTRATE REF STANDARD
PKA: 6.0
SOLUBILITY: DMF: SOLUBLE
SOLUBILITY: DMSO: SOLUBLE
SOLUBILITY: METHANOL: SOLUBLE
UNSPSC: 12352200
WGK: 3

Safety information

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