Cocamidopropyl betaine

• CAS: 86438-79-1
• Catalog Number: ACM86438791
• Category: Other Products
• Molecular Weight: 342.52
• Molecular Formula: C19H38N2O3
• Synonyms: {[3-(Dodecanoylamino)propyl](dimethyl)ammonio}acetate
• IUPAC Name: 2-[3-(dodecanoylamino)propyl-dimethylazaniumyl]acetate
• InChI: InChI=1S/C19H38N2O3/c1-4-5-6-7-8-9-10-11-12-14-18(22)20-15-13-16-21(2,3)17-19(23)24/h4-17H2,1-3H3,(H-,20,22,23,24)
• InChI Key: MRUAUOIMASANKQ-UHFFFAOYSA-N
• Boiling Point: 650.63 °C (Predicted)
• Melting Point: 282.96 °C (Predicted)
• Appearance: Liquid
• Complexity: 338
• EC Number: 263-058-8
• Exact Mass: 342.28824308
• Formal Charge: 0
• Heavy Atom Count: 24
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Isomeric SMILES: CCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)[O-]
• MDL Number: MFCD00239947
• Monoisotopic Mass: 342.28824308
• Rotatable Bond Count: 15
• Storage Conditions: Room temperature
• Topological Polar Surface Area: 69.2 Ų
• XLogP3-AA: 5.4

Custom Q&A

What is the molecular formula of Cocamidopropyl betaine?

The molecular formula of Cocamidopropyl betaine is C19H38N2O3.

What are some synonyms for Cocamidopropyl betaine?

Some synonyms for Cocamidopropyl betaine include Lauroylamide propylbetaine and Cocamidopropyl betaine.

What is the molecular weight of Cocamidopropyl betaine?

The molecular weight of Cocamidopropyl betaine is 342.5 g/mol.

What is the parent compound of Cocamidopropyl betaine?

The parent compound of Cocamidopropyl betaine is CID 20281 (Lauramidopropylbetaine).

What is the IUPAC Name of Cocamidopropyl betaine?

The IUPAC Name of Cocamidopropyl betaine is 2-[3-(dodecanoylamino)propyl-dimethylazaniumyl]acetate.

What is the InChIKey of Cocamidopropyl betaine?

The InChIKey of Cocamidopropyl betaine is MRUAUOIMASANKQ-UHFFFAOYSA-N.

What is the Canonical SMILES of Cocamidopropyl betaine?

The Canonical SMILES of Cocamidopropyl betaine is CCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)[O-].

What is the CAS number for Cocamidopropyl betaine?

The CAS numbers for Cocamidopropyl betaine are 4292-10-8, 86438-79-1, and 61789-40-0.

What is the UNII number for Cocamidopropyl betaine?

The UNII number for Cocamidopropyl betaine is 23D6XVI233.

What is the molecular weight and XLogP3-AA of Cocamidopropyl betaine?

The molecular weight of Cocamidopropyl betaine is 342.5 g/mol, and XLogP3-AA is 5.4.