8-Methoxy-3,4-dihydronaphthalen-1(2H)-one - CAS 13185-18-7
Catalog: |
BB007504 |
Product Name: |
8-Methoxy-3,4-dihydronaphthalen-1(2H)-one |
CAS: |
13185-18-7 |
Synonyms: |
8-methoxy-3,4-dihydro-2H-naphthalen-1-one; 8-methoxy-3,4-dihydro-2H-naphthalen-1-one |
IUPAC Name: | 8-methoxy-3,4-dihydro-2H-naphthalen-1-one |
Description: | 8-Methoxy-3,4-dihydronaphthalen-1(2H)-one (CAS# 13185-18-7) is a useful research chemical. |
Molecular Weight: | 176.21 |
Molecular Formula: | C11H12O2 |
Canonical SMILES: | COC1=CC=CC2=C1C(=O)CCC2 |
InChI: | InChI=1S/C11H12O2/c1-13-10-7-3-5-8-4-2-6-9(12)11(8)10/h3,5,7H,2,4,6H2,1H3 |
InChI Key: | DJFIWDAAEBDDES-UHFFFAOYSA-N |
Boiling Point: | 324.8 °C at 760 mmHg |
Density: | 1.124 g/cm3 |
Storage: | Sealed in dry, Room Temperature |
MDL: | MFCD01546945 |
LogP: | 2.21420 |
Publication Number | Title | Priority Date |
CA-3064484-A1 | Ion channel inhibitor compounds for cancer treatment | 20170523 |
EP-3630759-A1 | Ion channel inhibitor compounds for cancer treatment | 20170523 |
WO-2018215557-A1 | Ion channel inhibitor compounds for cancer treatment | 20170523 |
JP-2020520982-A | Ion channel inhibitor compounds for cancer treatment | 20170523 |
US-2021009581-A1 | Ion channel inhibitor compounds for cancer treatment | 20170523 |
Complexity: | 200 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 176.083729621 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 176.083729621 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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