Carbamic acid,4-naphthoquinone
TL;DR: Carbamic acid,4-naphthoquinone (CAS 2151-18-0) is a chemical compound with molecular formula C25H33Cl2NO5 and molecular weight 497.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-(1-hydroxy-3,4-dioxonaphthalen-2-yl)decyl N,N-bis(2-chloroethyl)carbamate
Also Known As: Carbamic acid,4-naphthoquinone, 10-(1-hydroxy-3,4-dioxo-3,4-dihydronaphthalen-2-yl)decyl bis(2-chloroethyl)carbamate, 10-(1-hydroxy-3,4-dioxonaphthalen-2-yl)decyl N,N-bis(2-chlor, 10-(1-hydroxy-3,4-dioxonaphthalen-2-yl)decyl N,N-bis(2-chloroethyl)carbamate
| Molecular Formula | C25H33Cl2NO5 |
|---|---|
| Molecular Weight | 497.17 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 83.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 16 |
| Exact Mass | 497.17358 |
| Heavy Atoms | 33 |
| Complexity | 676.0 |
Chemical Identifiers
| CAS Number | 2151-18-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(C(=O)C2=O)CCCCCCCCCCOC(=O)N(CCCl)CCCl)O |
| InChIKey | RSYFZEUQLNXJDC-UHFFFAOYSA-N |
Product Overview
Carbamic acid,4-naphthoquinone (CAS 2151-18-0), with molecular formula C25H33Cl2NO5 and molecular weight 497.17 g/mol. IUPAC: 10-(1-hydroxy-3,4-dioxonaphthalen-2-yl)decyl N,N-bis(2-chloroethyl)carbamate.
Chemical Property Profile of Carbamic acid,4-naphthoquinone
Property Insights of Carbamic acid,4-naphthoquinone
The XLogP value of 6.2 indicates that Carbamic acid,4-naphthoquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid,4-naphthoquinone. Following Lipinski's Rule of Five, Carbamic acid,4-naphthoquinone has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Carbamic acid,4-naphthoquinone?
The CAS number of Carbamic acid,4-naphthoquinone is 2151-18-0.
What is the molecular formula of Carbamic acid,4-naphthoquinone?
The molecular formula of Carbamic acid,4-naphthoquinone is C25H33Cl2NO5.
What is the molecular weight of Carbamic acid,4-naphthoquinone?
The molecular weight of Carbamic acid,4-naphthoquinone is 497.17 g/mol.
Where can I buy Carbamic acid,4-naphthoquinone?
You can request a quote for Carbamic acid,4-naphthoquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid,4-naphthoquinone?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid,4-naphthoquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.