3-Chloro-6,11-dihydro-5,5-dioxo-11-hydroxy-6-methyldibenzo[c,f][1,2]thiazepine, 95%

Name: 3-Chloro-6,11-dihydro-5,5-dioxo-11-hydroxy-6-methyldibenzo[c,f][1,2]thiazepine, 95%
SKU: ACM26723604
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Catalog NumberACM26723604

CAS Number26723-60-4

CategoryOther Glass and Ceramic Materials

IUPAC Name

3-chloro-6-methyl-5,5-dioxo-11H-benzo[c][2,1]benzothiazepin-11-ol

Molecular Weight

309.8g/mol

Molecular Formula

C14H12ClNO3S

Canonical SMILES

CN1C2=CC=CC=C2C(C3=C(S1(=O)=O)C=C(C=C3)Cl)O

InChI

InChI=1S/C14H12ClNO3S/c1-16-12-5-3-2-4-10(12)14(17)11-7-6-9(15)8-13(11)20(16,18)19/h2-8,14,17H,1H3

InChI Key

KBRSJPHSCOAFDR-UHFFFAOYSA-N

Complexity

464

Covalently-Bonded Unit Count

EC Number

247-944-1

Exact Mass

309.022642g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

309.022642g/mol

Rotatable Bond Count

XLogP3

2.1

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