beta-Dimorphecolic acid , CAS No.18104-44-4

CAS: 18104-44-4 Cat. No.: B1236791 Summenformel: C₁₈H₃₂O₃ Molekulargewicht: 296.44 PubChem CID: 6610222

Storage

Room temperature

Shipped In

Normal

Specifications

Storage

Room temperature

Verschickt in

Normal

Namen und Kennungen

• Kanonisches Lächeln: CCCCCC=CC=CC(CCCCCCCC(=O)O)O
• IUPAC Name: (9S)-9-hydroxyoctadeca-10,12-dienoic acid
• InChIKey: NPDSHTNEKLQQIJ-QGZVFWFLSA-N
• INCHI: 1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/t17-/m1/s1
• Isomere SMILES: CCCCCC=CC=C[C@H](CCCCCCCC(=O)O)O
• PubChem CID: 6610222
• Molekulargewicht: 296.44

Chemische und physikalische Eigenschaften

• Molekulargewicht: 296.400 g/mol
• XLogP3: 5.300
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 14
• Exact Mass: 296.235 Da
• Monoisotopic Mass: 296.235 Da
• Topological Polar Surface Area: 57.500 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 295.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 2
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 2
• Covalently-Bonded Unit Count: 1

Häufig gestellte Fragen

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 18104-44-4, the molecular formula is C18H32O3, and the molecular weight is 296.44 g/mol. InChIKey NPDSHTNEKLQQIJ-QGZVFWFLSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.