6,7-Methylenedioxy-4-isocyanatomethylcoumarin

Catalog Number

ACM97744893-1

CAS

97744-89-3

Structure

Synonyms

4-Isocyanatomethyl-6,7-methylenedioxycoumarin;6,7-Methylenedioxy-4-isocyanatomethylcoumarin;8-(isocyanatomethyl)-[1,3]dioxolo[4,5-g]chromen-6-one;4,7-Methylenedioxy-4-isocyanate-methylcoumarin

IUPAC Name

8-(isocyanatomethyl)-[1,3]dioxolo[4,5-g]chromen-6-one

Molecular Weight

245.19

Molecular Formula

C12H7NO5

Canonical SMILES

C1OC2=C(O1)C=C3C(=C2)C(=CC(=O)O3)CN=C=O

InChI

InChI=1S/C12H7NO5/c14-5-13-4-7-1-12(15)18-9-3-11-10(2-8(7)9)16-6-17-11/h1-3H,4,6H2

InChI Key

WIZBKPDCGYLOMY-UHFFFAOYSA-N

Purity

≥97%

Density

1.06 g/ml

Appearance

Powder or solid

Storage

-20 °C in the dark

• Catalog Number: ACM97744893-1
• CAS: 97744-89-3
• Synonyms: 4-Isocyanatomethyl-6,7-methylenedioxycoumarin;6,7-Methylenedioxy-4-isocyanatomethylcoumarin;8-(isocyanatomethyl)-[1,3]dioxolo[4,5-g]chromen-6-one;4,7-Methylenedioxy-4-isocyanate-methylcoumarin
• IUPAC Name: 8-(isocyanatomethyl)-[1,3]dioxolo[4,5-g]chromen-6-one
• Molecular Weight: 245.19
• Molecular Formula: C12H7NO5
• Canonical SMILES: C1OC2=C(O1)C=C3C(=C2)C(=CC(=O)O3)CN=C=O
• InChI: InChI=1S/C12H7NO5/c14-5-13-4-7-1-12(15)18-9-3-11-10(2-8(7)9)16-6-17-11/h1-3H,4,6H2
• InChI Key: WIZBKPDCGYLOMY-UHFFFAOYSA-N
• Purity: ≥97%
• Density: 1.06 g/ml
• Appearance: Powder or solid
• Storage: -20 °C in the dark