1,4,4a,8a-Tetrahydro-endo-1,4-methanonaphthalene-5,8-dione - CAS 51175-59-8
Catalog: |
BB027358 |
Product Name: |
1,4,4a,8a-Tetrahydro-endo-1,4-methanonaphthalene-5,8-dione |
CAS: |
51175-59-8 |
Synonyms: |
tricyclo[6.2.1.02,7]undeca-4,9-diene-3,6-dione |
IUPAC Name: | tricyclo[6.2.1.02,7]undeca-4,9-diene-3,6-dione |
Description: | 1,4,4a,8a-Tetrahydro-endo-1,4-methanonaphthalene-5,8-dione (CAS# 51175-59-8 ) is a useful research chemical. |
Molecular Weight: | 174.20 |
Molecular Formula: | C11H10O2 |
Canonical SMILES: | C1C2C=CC1C3C2C(=O)C=CC3=O |
InChI: | InChI=1S/C11H10O2/c12-8-3-4-9(13)11-7-2-1-6(5-7)10(8)11/h1-4,6-7,10-11H,5H2 |
InChI Key: | FQLRTGXTYFCECH-UHFFFAOYSA-N |
Boiling Point: | 317.556 °C at 760 mmHg |
Density: | 1.274 g/cm3 |
MDL: | MFCD00083094 |
LogP: | 1.13270 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020191340-A1 | Chalcogenide hybrid organic/inorganic polymers and methods for producing and using the same | 20190320 |
KR-101911423-B1 | Norbornene-based compound and method of preparing the norbornene-based compound | 20170425 |
KR-101921484-B1 | Norbornene-based compound and method of preparing the norbornene-based compound | 20170425 |
KR-20180119401-A | Norbornene-based compound and method of preparing the norbornene-based compound | 20170425 |
CN-105111059-A | Method for synthesizing hydroxyl group through reducing single side of pentacycloundecanedione (PCUD) | 20150712 |
PMID | Publication Date | Title | Journal |
5656473 | 19680501 | Antiprotozoal quinones. I. Synthesis of 2-hydroxy-3-alkyl-1,4-naphthoquinones as potential coccidiostats | Journal of medicinal chemistry |
Complexity: | 319 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 174.068079557 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 174.068079557 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 34.1 Å2 |
Undefined Atom Stereocenter Count: | 4 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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