1,4-Naphthoquinone, 2-isopropyl-
TL;DR: 1,4-Naphthoquinone, 2-isopropyl- (CAS 20175-89-7) is a chemical compound with molecular formula C13H12O2 and molecular weight 200.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propan-2-ylnaphthalene-1,4-dione
Also Known As: 1,4-Naphthoquinone, 2-isopropyl-, 2-Isopropyl-1,4-naphthoquinone, isopropyl-1,4-naphthoquinone, 2-propan-2-ylnaphthalene-1,4-dione, 2-(Propan-2-yl)naphthalene-1,4-dione
| Molecular Formula | C13H12O2 |
|---|---|
| Molecular Weight | 200.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 200.08372 |
| Heavy Atoms | 15 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 20175-89-7 |
|---|---|
| SMILES | CC(C)C1=CC(=O)C2=CC=CC=C2C1=O |
| InChIKey | UXDUZIOHEZGEBC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Naphthoquinone, 2-isopropyl- (CAS 20175-89-7), with molecular formula C13H12O2 and molecular weight 200.08 g/mol. IUPAC: 2-propan-2-ylnaphthalene-1,4-dione.
Chemical Property Profile of 1,4-Naphthoquinone, 2-isopropyl-
Property Insights of 1,4-Naphthoquinone, 2-isopropyl-
The XLogP value of 3.0 indicates that 1,4-Naphthoquinone, 2-isopropyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 1,4-Naphthoquinone, 2-isopropyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Naphthoquinone, 2-isopropyl- has 0 hydrogen bond donor(s) and 2 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 1,4-Naphthoquinone, 2-isopropyl-?
The CAS number of 1,4-Naphthoquinone, 2-isopropyl- is 20175-89-7.
What is the molecular formula of 1,4-Naphthoquinone, 2-isopropyl-?
The molecular formula of 1,4-Naphthoquinone, 2-isopropyl- is C13H12O2.
What is the molecular weight of 1,4-Naphthoquinone, 2-isopropyl-?
The molecular weight of 1,4-Naphthoquinone, 2-isopropyl- is 200.08 g/mol.
Where can I buy 1,4-Naphthoquinone, 2-isopropyl-?
You can request a quote for 1,4-Naphthoquinone, 2-isopropyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Naphthoquinone, 2-isopropyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Naphthoquinone, 2-isopropyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.