3-chlorobutanoic acid

Summary

3-chlorobutanoic acid is a group of stereoisomers^[1].

Key Facts

• 3-chlorobutanoic acid's instance of is recorded as group of stereoisomers^[2].
• 3-chlorobutanoic acid's chemical structure is recorded as 3-chlorobutanoic acid.svg^[3].
• 3-chlorobutanoic acid's CAS Registry Number is recorded as 1951-12-8^[4].
• 3-chlorobutanoic acid's canonical SMILES is recorded as CC(CC(=O)O)Cl^[5].
• 3-chlorobutanoic acid's InChI is recorded as InChI=1S/C4H7ClO2/c1-3(5)2-4(6)7/h3H,2H2,1H3,(H,6,7)^[6].
• 3-chlorobutanoic acid's InChIKey is recorded as XEEMVPPCXNTVNP-UHFFFAOYSA-N^[7].
• 3-chlorobutanoic acid's chemical formula is recorded as C₄H₇ClO₂^[8].
• 3-chlorobutanoic acid's subclass of is recorded as chemical compound^[9].
• 3-chlorobutanoic acid's Commons category is recorded as 3-Chlorobutanoic acid^[10].
• 3-chlorobutanoic acid's UNII is recorded as L4Z4247DP7^[11].
• 3-chlorobutanoic acid's PubChem CID is recorded as 16048^[12].
• 3-chlorobutanoic acid's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+122.013457144'}^[13].
• 3-chlorobutanoic acid's NSC number is recorded as 404459^[14].
• 3-chlorobutanoic acid's SureChEMBL ID is recorded as 158448^[15].
• 3-chlorobutanoic acid's DSSTox substance ID is recorded as DTXSID90883783^[16].
• 3-chlorobutanoic acid's DSSTOX compound identifier is recorded as DTXCID10892812^[17].
• 3-chlorobutanoic acid's NMRShiftDB structure ID is recorded as 20026303^[18].
• 3-chlorobutanoic acid's UniChem compound ID is recorded as 24702112^[19].