Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1)
TL;DR: Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1) (CAS 61827-44-9) is a chemical compound with molecular formula C15H22CaO2 and molecular weight 274.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium;formaldehyde;2-(2,4,4-trimethylpentan-2-yl)phenolate
Also Known As: (C14-H22-O.C-H2-O)x-.x-Ca, Phenol, (1,1,3,3-tetramethylbutyl)-, polymer with formaldehyde, calcium salt, calcium; formaldehyde; 2-(2,4,4-trimethylpentan-2-yl)phenolate, Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1)
| Molecular Formula | C15H22CaO2 |
|---|---|
| Molecular Weight | 274.12 g/mol |
| LogP | 2.72249 |
| Topological Polar Surface Area | 40.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.12457 |
| Heavy Atoms | 18 |
| Complexity | 353.75638 |
Chemical Identifiers
| CAS Number | 61827-44-9 |
|---|---|
| SMILES | CC(C)(C)[CH-]C(C)(C)C1=CC=CC=C1[O-].C=O.[Ca+2] |
Product Overview
Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1) (CAS 61827-44-9), with molecular formula C15H22CaO2 and molecular weight 274.12 g/mol. IUPAC: calcium;formaldehyde;2-(2,4,4-trimethylpentan-2-yl)phenolate.
Chemical Property Profile of Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1)
Property Insights of Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1)
The XLogP value of 2.72249 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1). With a topological polar surface area (TPSA) of 40.13 Ų, Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1) has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1)?
The CAS number of Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1) is 61827-44-9.
What is the molecular formula of Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1)?
The molecular formula of Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1) is C15H22CaO2.
What is the molecular weight of Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1)?
The molecular weight of Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1) is 274.12 g/mol.
Where can I buy Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1)?
You can request a quote for Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1)?
Yes, KEHONG BIO provides custom synthesis services for Calcium 2-(2,4,4-trimethylpentan-3-id-2-yl)phenolate--formaldehyde (1/1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.