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3-Chloro-2H-1-Benzopyran-2-One
[CAS# 92-45-5]

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Identification
Classification Pharmaceutical intermediate >> Heterocyclic compound intermediate >> Pyran compound
Name 3-Chloro-2H-1-Benzopyran-2-One
Synonyms 3-Chloro-2-Chromenone; 3-Chlorocoumarin; 3-Chloro-2H-1-Benzopyran-2-One
Molecular Structure CAS#: 92-45-5, 3-Chloro-2H-1-Benzopyran-2-One
Molecular Formula C9H5ClO2
Molecular Weight 180.59
CAS Registry Number 92-45-5
SMILES C1=CC=CC2=C1C=C(Cl)C(O2)=O
InChI 1S/C9H5ClO2/c10-7-5-6-3-1-2-4-8(6)12-9(7)11/h1-5H
InChIKey CKCOPMSBJBNBCQ-UHFFFAOYSA-N
Properties
Density 1.4±0.1g/cm3 (Cal.)
Melting point 121-125°C (Expl.)
Boiling point 325.4±30.0°C at 760 mmHg (Cal.)
Flash point 175.0±20.0°C (Cal.)
Safety Data
Safety Code S26;S37  Details
Risk Code R36/37/38  Details
Hazard Symbol symbol  X  Details
Safety Description HARMFUL / IRRITANT
WARNING: Irritates lungs, eyes, skin
SDS Available
Market Analysis Reports
List of Reports Available for 3-Chloro-2H-1-Benzopyran-2-One
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