Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)-
TL;DR: Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)- (CAS 112051-05-5) is a chemical compound with molecular formula C11H14N2OS2 and molecular weight 254.05475 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2Z)-2-hydroxyimino-2-phenylethyl] N,N-dimethylcarbamodithioate
Also Known As: Oxime of 2-(n,n-dimethylthiocarbamoyl thio)-acetophenone, (2Z)-2-(Hydroxyimino)-2-phenylethyl dimethylcarbamodithioate, Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)-, [(2Z)-2-hydroxyimino-2-phenylethyl] N,N-dimethylcarbamodithioate
Technical Specifications
| Molecular Formula | C11H14N2OS2 |
| Molecular Weight | 254.05475 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 93.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.05475 Da |
| Heavy Atoms | 16 |
| Complexity | 261.0 |
| SMILES | CN(C)C(=S)SC/C(=N\O)/C1=CC=CC=C1 |
| InChIKey | FCNHKPLMPCWIQH-ZRDIBKRKSA-N |
Chemical Property Profile of Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)-
Property Insights of Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)-. The TPSA of 93.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)-. Following Lipinski's Rule of Five, Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)-?
The CAS number of Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)- is 112051-05-5.
What is the molecular formula of Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)-?
The molecular formula of Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)- is C11H14N2OS2.
What is the molecular weight of Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)-?
The molecular weight of Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)- is 254.05475 g/mol.
Where can I buy Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)-?
You can request a quote for Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)-?
Yes, CoreyChem provides custom synthesis services for Carbamodithioic acid, dimethyl-, 2-(hydroxyimino)-2-phenylethyl ester, (Z)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.