200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 615-94-1
615-94-1 | 2,5-Dihydroxycyclohexa-2,5-diene-1,4-dione
CAS No: 615-94-1 Catalog No: AG003B5D MDL No:MFCD00001598
Product Description
Catalog Number:
AG003B5D
Chemical Name:
2,5-Dihydroxycyclohexa-2,5-diene-1,4-dione
CAS Number:
615-94-1
Molecular Formula:
C6H4O4
Molecular Weight:
140.0936
MDL Number:
MFCD00001598
IUPAC Name:
2,5-dihydroxycyclohexa-2,5-diene-1,4-dione
InChI:
InChI=1S/C6H4O4/c7-3-1-4(8)6(10)2-5(3)9/h1-2,7,10H
InChI Key:
QFSYADJLNBHAKO-UHFFFAOYSA-N
SMILES:
OC1=CC(=O)C(=CC1=O)O
EC Number:
210-454-3
UNII:
0KG5HVB52Z
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.011g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
140.094g/mol
Monoisotopic Mass:
140.011g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
Literature
| Title | Journal |
|---|---|
| Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods. | Journal of molecular graphics & modelling 20061101 |
| Identification and characterization of hydroxyquinone hydratase activities from Sphingobium chlorophenolicum ATCC 39723. | Biodegradation 20050801 |
| Inelastic neutron scattering (INS) studies on 2,5-dihydroxy-1,4-benzoquinone (DHBQ). | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20030201 |
| Anti-HSV-1 activity of synthetic humic acid-like polymers derived from p-diphenolic starting compounds. | Antiviral chemistry & chemotherapy 20020701 |
| Comparison of conventional and synchrotron X-ray structure determinations of the adduct 1,2,4,5-tetrahydroxybenzene-2,5-dihydroxy-1,4-benzoquinone (1/1) and a conventional X-ray structure determination of 1,2,4,5-tetrahydroxybenzene monohydrate. | Acta crystallographica. Section C, Crystal structure communications 20010601 |
| Steroid hormone activity of flavonoids and related compounds. | Breast cancer research and treatment 20000701 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.