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Structure

5-(4-Chlorophenyl)isoxazole-3-carboxylic acid

CAS
33282-22-3
Catalog Number
ACM33282223
Category
Other Products
Molecular Weight
223.61
Molecular Formula
C10H6ClNO3

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Specification

Synonyms
ZINC00874633, CID6969938, 33282-22-3
IUPAC Name
5-(4-chlorophenyl)-1,2-oxazole-3-carboxylate
Canonical SMILES
C1=CC(=CC=C1C2=CC(=NO2)C(=O)O)Cl
InChI Key
CRTZVRLESCICCT-UHFFFAOYSA-M
Boiling Point
457.3ºC at 760mmHg
Melting Point
200.0ºC (dec.)(lit.)
Flash Point
230.4ºC
Exact Mass
223.00400
Hazard Statements
Xn: Harmful;
H-Bond Acceptor
4
H-Bond Donor
0
WGK Germany
3
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