3-Chlorocoumarin

Catalog Number

ACM92455-1

CAS

92-45-5

Structure

Synonyms

3-Chloro-2H-chromen-2-one

IUPAC Name

3-chlorochromen-2-one

Molecular Weight

180.59

Molecular Formula

C9H5ClO2

Canonical SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)Cl

InChI

InChI=1S/C9H5ClO2/c10-7-5-6-3-1-2-4-8(6)12-9(7)11/h1-5H

InChI Key

CKCOPMSBJBNBCQ-UHFFFAOYSA-N

Melting Point

121.0 - 125.0 °C

Purity

≥97%

Appearance

Powder or solid

Storage

-20 °C in the dark

• Catalog Number: ACM92455-1
• CAS: 92-45-5
• Synonyms: 3-Chloro-2H-chromen-2-one
• IUPAC Name: 3-chlorochromen-2-one
• Molecular Weight: 180.59
• Molecular Formula: C9H5ClO2
• Canonical SMILES: C1=CC=C2C(=C1)C=C(C(=O)O2)Cl
• InChI: InChI=1S/C9H5ClO2/c10-7-5-6-3-1-2-4-8(6)12-9(7)11/h1-5H
• InChI Key: CKCOPMSBJBNBCQ-UHFFFAOYSA-N
• Melting Point: 121.0 - 125.0 °C
• Purity: ≥97%
• Appearance: Powder or solid
• Storage: -20 °C in the dark