2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)-
TL;DR: 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)- (CAS 77223-50-8) is a chemical compound with molecular formula C18H14O3 and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,4R)-3,4-dihydroxy-3,4-dihydro-1H-chrysen-2-one
Also Known As: 3,4-Dihydroxy-3,4-dihydrochrysen-2(1H)-one, (3S,4R)-3,4-dihydroxy-3,4-dihydrochrysen-2(1H)-one, 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)-, (3S,4R)-3,4-dihydroxy-3,4-dihydro-1H-chrysen-2-one, (3S,4S)-3,4-dihydroxy-3,4-dihydro-1H-chrysen-2-one
| Molecular Formula | C18H14O3 |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 278.0943 |
| Heavy Atoms | 21 |
| Complexity | 421.0 |
Chemical Identifiers
| CAS Number | 77223-50-8 |
|---|---|
| SMILES | C1C2=C([C@H]([C@@H](C1=O)O)O)C3=C(C=C2)C4=CC=CC=C4C=C3 |
| InChIKey | CMASQHPDXRRICX-QZTJIDSGSA-N |
Product Overview
2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)- (CAS 77223-50-8), with molecular formula C18H14O3 and molecular weight 278.09 g/mol. IUPAC: (3S,4R)-3,4-dihydroxy-3,4-dihydro-1H-chrysen-2-one.
Chemical Property Profile of 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)-
Property Insights of 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)-. With a topological polar surface area (TPSA) of 57.5 Ų, 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)- has 2 hydrogen bond donor(s) and 3 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 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)-?
The CAS number of 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)- is 77223-50-8.
What is the molecular formula of 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)-?
The molecular formula of 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)- is C18H14O3.
What is the molecular weight of 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)-?
The molecular weight of 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)- is 278.09 g/mol.
Where can I buy 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)-?
You can request a quote for 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)-?
Yes, KEHONG BIO provides custom synthesis services for 2(1H)-Chrysenone, 3,4-dihydro-3,4-dihydroxy-, (3S-trans)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.