(C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N
TL;DR: (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N (CAS 93966-93-9) is a chemical compound with molecular formula C25H31NO11 and molecular weight 521.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azane;furan-2,5-dione;(Z)-4-methoxy-4-oxobut-2-enoic acid;(Z)-4-(2-methylpropoxy)-4-oxobut-2-enoic acid;styrene
Also Known As: (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N, 2-Butenedioic acid (2Z)-, monomethyl ester, polymer with ethenylbenzene, 2,5-furandione and (2Z)-2-methylpropyl hydrogen 2-butenedioate, ammonium salt, 2-Butenedioic acid (2Z)-, 1-methyl ester, polymer with ethenylbenzene, 2,5-furandione and 1-(2-methylpropyl) hydrogen (2Z)-2-butenedioate, ammonium salt, 2-Butenedioic acid (2Z)-, monomethyl ester, polymer with ethenylbenzene, 2,5-furandione and (Z)-2-methylpropyl hydrogen 2-butenedioate, ammonium salt, 2-Butenedioic acid (Z)-, monomethyl ester, polymer with ethenylbenzene, 2,5-furandione and (Z)-2-methylpropyl hydrogen 2-butenedioate, ammonium salt
| Molecular Formula | C25H31NO11 |
|---|---|
| Molecular Weight | 521.19 g/mol |
| LogP | 2.7442 |
| Topological Polar Surface Area | 205.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 521.1897 |
| Heavy Atoms | 37 |
| Complexity | 961.6119 |
Chemical Identifiers
| CAS Number | 93966-93-9 |
|---|---|
| SMILES | CC(C)COC(=O)/C=C\C(=O)O.COC(=O)/C=C\C(=O)O.C=CC1=CC=CC=C1.C1=CC(=O)OC1=O.N |
Product Overview
(C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N (CAS 93966-93-9), with molecular formula C25H31NO11 and molecular weight 521.19 g/mol. IUPAC: azane;furan-2,5-dione;(Z)-4-methoxy-4-oxobut-2-enoic acid;(Z)-4-(2-methylpropoxy)-4-oxobut-2-enoic acid;styrene.
Chemical Property Profile of (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N
Property Insights of (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N
The XLogP value of 2.7442 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N. The TPSA of 205.57 Ų indicates high polarity, suggesting (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N?
The CAS number of (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N is 93966-93-9.
What is the molecular formula of (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N?
The molecular formula of (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N is C25H31NO11.
What is the molecular weight of (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N?
The molecular weight of (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N is 521.19 g/mol.
Where can I buy (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N?
You can request a quote for (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N?
Yes, KEHONG BIO provides custom synthesis services for (C8-H12-O4.C8-H8.C5-H6-O4.C4-H2-O3)x-.x-H3-N and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.