Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product
TL;DR: Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product (CAS 68442-57-9) is a chemical compound with molecular formula C30H47N3O6S2 and molecular weight 609.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azanium;[(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methanamine;formaldehyde;1-phenylethanone;sulfuric acid;thiocyanate
Also Known As: Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product, azanium; [(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methanamine; formaldehyde; 1-phenylethanone; sulfuric acid; thiocyanate, Thiocyanic acid, ammonium salt (1:1), reaction products with acetophenone, formaldehyde, (1R,4aS,10aR)-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenemethanamine and sulfuric acid, Thiocyanic acid, ammonium salt, reaction products with acetophenone, formaldehyde, (1R,4aS,10aR)-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenemethanamine and sulfuric acid, Thiocyanic acid, ammonium salt, reaction products with acetophenone, formaldehyde, [1R-(1.alpha.,4a.beta.,10a.alpha.)]-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenemethanamine and sulfuric acid
| Molecular Formula | C30H47N3O6S2 |
|---|---|
| Molecular Weight | 609.29 g/mol |
| LogP | 6.22108 |
| Topological Polar Surface Area | 169.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 609.29065 |
| Heavy Atoms | 41 |
| Complexity | 592.0 |
Chemical Identifiers
| CAS Number | 68442-57-9 |
|---|---|
| SMILES | CC(C)C1=CC2=C(C=C1)[C@]3(CCC[C@@]([C@@H]3CC2)(C)CN)C.CC(=O)C1=CC=CC=C1.C=O.C(#N)[S-].[NH4+].OS(=O)(=O)O |
| InChIKey | BEBIKGBSRJIUNY-WDSWIRCPSA-N |
Product Overview
Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product (CAS 68442-57-9), with molecular formula C30H47N3O6S2 and molecular weight 609.29 g/mol. IUPAC: azanium;[(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methanamine;formaldehyde;1-phenylethanone;sulfuric acid;thiocyanate.
Chemical Property Profile of Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product
Property Insights of Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product
The XLogP value of 6.22108 indicates that Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 169.0 Ų indicates high polarity, suggesting Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product has 4 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 Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product?
The CAS number of Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product is 68442-57-9.
What is the molecular formula of Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product?
The molecular formula of Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product is C30H47N3O6S2.
What is the molecular weight of Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product?
The molecular weight of Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product is 609.29 g/mol.
Where can I buy Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product?
You can request a quote for Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product?
Yes, KEHONG BIO provides custom synthesis services for Ammonium thiocyanate, dehydroabietylamine, acetophenone, formaldehyde, sulfuric acid, reaction product and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.