1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)-
TL;DR: 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)- (CAS 63978-91-6) is a chemical compound with molecular formula C14H13Cl2NO2 and molecular weight 297.03235 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[bis(2-chloroethyl)amino]naphthalene-1,4-dione
Also Known As: 2-Di amino-1,4-naphthoquinone, 1,3,5-Trithiane,phenol deriv., 1, 2-[bis(2-chloroethyl)amino]-, 2-(Di-2'-chloroethylamino)-1,4-naphthoquinone, 1,4-NAPHTHOQUINONE, 2-(DI-2'-CHLOROETHYLAMINO)-
Technical Specifications
| Molecular Formula | C14H13Cl2NO2 |
| Molecular Weight | 297.03235 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 297.03235 Da |
| Heavy Atoms | 19 |
| Complexity | 389.0 |
| SMILES | C1=CC=C2C(=C1)C(=O)C=C(C2=O)N(CCCl)CCCl |
| InChIKey | PHLZLDBVNZSBRA-UHFFFAOYSA-N |
Chemical Property Profile of 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)-
Property Insights of 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)-
The XLogP value of 3.1 indicates that 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)-?
The CAS number of 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)- is 63978-91-6.
What is the molecular formula of 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)-?
The molecular formula of 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)- is C14H13Cl2NO2.
What is the molecular weight of 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)-?
The molecular weight of 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)- is 297.03235 g/mol.
Where can I buy 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)-?
You can request a quote for 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)-?
Yes, CoreyChem provides custom synthesis services for 1,4-Naphthoquinone, 2-(di-2'-chloroethylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.