Calcium 2-ethylhexanoate

• CAS: 136-51-6
• Catalog Number: ACM136516
• Category: Micro/NanoElectronics
• Molecular Weight: 326.48
• Molecular Formula: C16H30CaO4
• Description: Liquid
• Synonyms: 2-Ethylhexanoic acid calcium salt
• IUPAC Name: Calcium;2-ethylhexanoate
• Canonical SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ca+2]
• InChI: InChI=1S/2C8H16O2.Ca/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;+2/p-2
• InChI Key: LTPCXXMGKDQPAO-UHFFFAOYSA-L
• Solubility: Insoluble in water
• Appearance: Viscous liquid
• Complexity: 93.9
• Covalently-Bonded Unit Count: 3
• EC Number: 205-249-0
• Exact Mass: 326.1770003
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 0
• Heavy Atom Count: 21
• Monoisotopic Mass: 326.1770003
• Rotatable Bond Count: 8
• Topological Polar Surface Area: 80.3 Ų

Custom Q&A

What is the molecular formula of Calcium 2-ethylhexanoate?

The molecular formula of Calcium 2-ethylhexanoate is C16H30CaO4.

What is the molecular weight of Calcium 2-ethylhexanoate?

The molecular weight of Calcium 2-ethylhexanoate is 326.48 g/mol.

What is the IUPAC name of Calcium 2-ethylhexanoate?

The IUPAC name of Calcium 2-ethylhexanoate is calcium;2-ethylhexanoate.

What is the InChI of Calcium 2-ethylhexanoate?

The InChI of Calcium 2-ethylhexanoate is InChI=1S/2C8H16O2.Ca/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+2/p-2.

What is the InChIKey of Calcium 2-ethylhexanoate?

The InChIKey of Calcium 2-ethylhexanoate is LTPCXXMGKDQPAO-UHFFFAOYSA-L.

What is the canonical SMILES of Calcium 2-ethylhexanoate?

The canonical SMILES of Calcium 2-ethylhexanoate is CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ca+2].

What is the CAS number of Calcium 2-ethylhexanoate?

The CAS number of Calcium 2-ethylhexanoate is 136-51-6.

What is the hydrogen bond donor count of Calcium 2-ethylhexanoate?

The hydrogen bond donor count of Calcium 2-ethylhexanoate is 0.

What is the hydrogen bond acceptor count of Calcium 2-ethylhexanoate?

The hydrogen bond acceptor count of Calcium 2-ethylhexanoate is 4.

How many covalently-bonded units are there in Calcium 2-ethylhexanoate?

There are 3 covalently-bonded units in Calcium 2-ethylhexanoate.