5,8-Dimethoxy-3,4-dihydronaphthalen-2(1H)-one - CAS 37464-90-7
Catalog: |
BB023296 |
Product Name: |
5,8-Dimethoxy-3,4-dihydronaphthalen-2(1H)-one |
CAS: |
37464-90-7 |
Synonyms: |
5,8-dimethoxy-3,4-dihydro-1H-naphthalen-2-one; 5,8-dimethoxy-3,4-dihydro-1H-naphthalen-2-one |
IUPAC Name: | 5,8-dimethoxy-3,4-dihydro-1H-naphthalen-2-one |
Description: | 5,8-Dimethoxy-3,4-dihydronaphthalen-2(1H)-one (CAS# 37464-90-7) is a compound useful in organic synthesis. |
Molecular Weight: | 206.24 |
Molecular Formula: | C12H14O3 |
Canonical SMILES: | COC1=C2CCC(=O)CC2=C(C=C1)OC |
InChI: | InChI=1S/C12H14O3/c1-14-11-5-6-12(15-2)10-7-8(13)3-4-9(10)11/h5-6H,3-4,7H2,1-2H3 |
InChI Key: | KZNQBPNFLGQMQR-UHFFFAOYSA-N |
Boiling Point: | 388.2 ℃ at 760 mmHg |
Density: | 1.14 g/cm3 |
MDL: | MFCD04038596 |
LogP: | 1.76160 |
Publication Number | Title | Priority Date |
CN-111646915-A | Amrubicin hydrochloride intermediate compound I | 20190304 |
CN-111646924-A | Aminorubicin hydrochloride intermediate compound I-4 | 20190304 |
CN-111646925-A | Amrubicin hydrochloride intermediate compound | 20190304 |
CN-111646928-A | Aminorubicin hydrochloride intermediate compound I-2 | 20190304 |
CN-101885674-A | Preparation method of 5,8-dimethoxy-2-tetralin ketone | 20090515 |
Complexity: | 239 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.094294304 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.094294304 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 35.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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