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Heptadecanedioic acid

Catalog Number ACM2424900-1
CAS 2424-90-0
Structure Heptadecanedioic acid
Synonyms 1,15-Pentadecanedicarboxylic Acid
IUPAC Name heptadecanedioic acid
Molecular Weight 300.43
Molecular Formula C17H32O4
Canonical SMILES C(CCCCCCCC(=O)O)CCCCCCCC(=O)O
InChI QCNWZROVPSVEJA-UHFFFAOYSA-N
InChI Key InChI=1S/C17H32O4/c18-16(19)14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17(20)21/h1-15H2,(H,18,19)(H,20,21)
Boiling Point 170-190 °C at 0.3 Torr
Melting Point 121 °C
Purity 99%
Density 1.006±0.06 g/cm3(Predicted)
Appearance Solid
Complexity 238
Covalently-Bonded Unit Count 1
Exact Mass 300.23006g/mol
Formal Charge 0
Heavy Atom Count 21
Isomeric SMILES C(CCCCCCCC(=O)O)CCCCCCCC(=O)O
Monoisotopic Mass 300.23006g/mol
Rotatable Bond Count 16

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