CAS
6543-04-0 Purity
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6543-04-0 Purity
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Specification
The molecular formula is C5H8O4.
It has a molecular weight of 132.11 g/mol.
The IUPAC name is 2-methyl-1,3-dioxolane-2-carboxylic acid.
The InChI code is InChI=1S/C5H8O4/c1-5(4(6)7)8-2-3-9-5/h2-3H2,1H3,(H,6,7).
The InChIKey is ZHGDCOBQAGUTIW-UHFFFAOYSA-N.
The canonical SMILES is CC1(OCCO1)C(=O)O.
The CAS number is 5736-04-9.
It has 1 hydrogen bond donor count.
It has 4 hydrogen bond acceptor counts.
Yes, it is considered a canonicalized compound.