Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro-
TL;DR: Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro- (CAS 36635-41-3) is a chemical compound with molecular formula C10H10N2O4S and molecular weight 254.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(cyclopropylmethylsulfanyl)-2,4-dinitrobenzene
Also Known As: Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro-, 1-(cyclopropylmethylsulfanyl)-2,4-dinitrobenzene, cyclopropylmethyl 2,4-dinitrophenyl sulphide, 1-(cyclopropylmethylsulfanyl)-2,4-dinitro-benzene, 1-[(CYCLOPROPYLMETHYL)SULFANYL]-2,4-DINITROBENZENE
| Molecular Formula | C10H10N2O4S |
|---|---|
| Molecular Weight | 254.04 g/mol |
| LogP | 3.0051 |
| Topological Polar Surface Area | 86.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 254.03613 |
| Heavy Atoms | 17 |
| Complexity | 473.37375 |
Chemical Identifiers
| CAS Number | 36635-41-3 |
|---|---|
| SMILES | C1CC1CSC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro- (CAS 36635-41-3), with molecular formula C10H10N2O4S and molecular weight 254.04 g/mol. IUPAC: 1-(cyclopropylmethylsulfanyl)-2,4-dinitrobenzene.
Chemical Property Profile of Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro-
Property Insights of Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro-
The XLogP value of 3.0051 indicates that Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.28 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro-. Following Lipinski's Rule of Five, Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro- has 0 hydrogen bond donor(s) and 5 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 Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro-?
The CAS number of Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro- is 36635-41-3.
What is the molecular formula of Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro-?
The molecular formula of Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro- is C10H10N2O4S.
What is the molecular weight of Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro-?
The molecular weight of Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro- is 254.04 g/mol.
Where can I buy Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro-?
You can request a quote for Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-[(cyclopropylmethyl)thio]-2,4-dinitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.