(C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x-
TL;DR: (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x- (CAS 42276-83-5) is a chemical compound with molecular formula C30H44O9 and molecular weight 548.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxypropyl 2-methylprop-2-enoate;2-methylidenehexanoic acid;methyl 2-methylprop-2-enoate;prop-2-enoic acid;styrene
Also Known As: (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x-, 2-hydroxypropyl 2-methylprop-2-enoate; 2-methylidenehexanoic acid; methyl 2-methylprop-2-enoate; prop-2-enoic acid; styrene, acrylic acid; 2-hydroxypropyl 2-methylprop-2-enoate; 2-methylenehexanoic acid; methyl 2-methylprop-2-enoate; styrene, 2-Propenoic acid, 2-methyl-, methyl ester, polymer with butyl 2-propenoate, ethenylbenzene, 1,2-propanediol mono(2-methyl-2-propenoate) and 2-propenoic acid, 2-Propenoic acid, 2-methyl-, monoester with 1,2-propanediol, polymer with butyl 2-propenoate, ethenylbenzene, methyl 2-methyl-2-propenoate and 2-propenoic acid
| Molecular Formula | C30H44O9 |
|---|---|
| Molecular Weight | 548.30 g/mol |
| LogP | 5.626 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 548.2985 |
| Heavy Atoms | 39 |
| Complexity | 474.0 |
Chemical Identifiers
| CAS Number | 42276-83-5 |
|---|---|
| SMILES | CCCCC(=C)C(=O)O.CC(COC(=O)C(=C)C)O.CC(=C)C(=O)OC.C=CC1=CC=CC=C1.C=CC(=O)O |
| InChIKey | BGANBXAFSSDFNV-UHFFFAOYSA-N |
Product Overview
(C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x- (CAS 42276-83-5), with molecular formula C30H44O9 and molecular weight 548.30 g/mol. IUPAC: 2-hydroxypropyl 2-methylprop-2-enoate;2-methylidenehexanoic acid;methyl 2-methylprop-2-enoate;prop-2-enoic acid;styrene.
Chemical Property Profile of (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x-
Property Insights of (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x-
The XLogP value of 5.626 indicates that (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 147.0 Ų indicates high polarity, suggesting (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x- has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x-?
The CAS number of (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x- is 42276-83-5.
What is the molecular formula of (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x-?
The molecular formula of (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x- is C30H44O9.
What is the molecular weight of (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x-?
The molecular weight of (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x- is 548.30 g/mol.
Where can I buy (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x-?
You can request a quote for (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x-?
Yes, KEHONG BIO provides custom synthesis services for (C8-H8.C7-H12-O3.C7-H12-O2.C5-H8-O2.C3-H4-O2)x- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.