(+)-Indacrinone

Base Information

Chemical Name:(+)-Indacrinone
CAS No.:57297-16-2
Molecular Formula:C18H14 Cl2 O4
Molecular Weight:365.213
Hs Code.:
European Community (EC) Number:260-667-0
UNII:5R40KYE9MR
ChEMBL ID:CHEMBL2092906
DSSTox Substance ID:DTXSID201124394
Nikkaji Number:J70.986G
Wikidata:Q27895809
Mol file:57297-16-2.mol

Synonyms:(+)-Indacrinone;57297-16-2;Indacrinone, (S)-;5R40KYE9MR;(+)-MK 196;(S)-indacrinone;ACETIC ACID, (((2S)-6,7-DICHLORO-2,3-DIHYDRO-2-METHYL-1-OXO-2-PHENYL-1H-INDEN-5-YL)OXY)-;Acetic acid, [[(2S)-6,7-dichloro-2,3-dihydro-2-methyl-1-oxo-2-phenyl-1H-inden-5-yl]oxy]-;EINECS 260-667-0;UNII-5R40KYE9MR;(S)-(+)-INDACRINONE;CHEMBL2092906;DTXSID201124394;(+)-6,7-Dichloro-2-methyl-1-oxo-2-phenyl-5-indanyloxyacetic acid;Acetic acid, ((2,3-dihydro-6,7-dichloro-2-methyl-1-oxo-2-phenyl-1H-inden-5-yl)oxy)-, (+)-;NS00052701;Q27895809;(S)-((6,7-Dichloro-2,3-dihydro-2-methyl-1-oxo-2-phenyl-1H-inden-5-yl)oxy)acetic acid;ACETIC ACID, ((6,7-DICHLORO-2,3-DIHYDRO-2-METHYL-1-OXO-2-PHENYL-1H-INDEN-5-YL)OXY)-, (S)-

Suppliers and Price of (+)-Indacrinone

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 3 raw suppliers

Chemical Property of (+)-Indacrinone

Chemical Property:

Boiling Point:553.6°Cat760mmHg
Flash Point:288.6°C
PSA：63.60000
Density:1.422g/cm³
LogP:4.15350
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:364.0269143
Heavy Atom Count:24
Complexity:505

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCC(=O)O)C3=CC=CC=C3
Isomeric SMILES:C[C@]1(CC2=CC(=C(C(=C2C1=O)Cl)Cl)OCC(=O)O)C3=CC=CC=C3

Technology Process of (+)-Indacrinone

There total 3 articles about (+)-Indacrinone which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 88440-75-9
((S)-6,7-Dichloro-2-methyl-1-oxo-2-phenyl-indan-5-yloxy)-acetic acid ethyl ester

: 57297-16-2,57296-63-6
S-(+)-indacrinone

Guidance literature:: With hydrogenchloride; sodium hydroxide; In toluene; Yield given; Heating;
DOI:10.1021/ja00314a045

Reference yield:

: 57296-65-8,57509-50-9,76640-83-0,76640-84-1
(S)-6,7-Dichloro-5-hydroxy-2-methyl-2-phenyl-indan-1-one

: 57297-16-2,57296-63-6
S-(+)-indacrinone

Guidance literature:: Multi-step reaction with 2 steps

1: K₂CO₃, NaI / toluene / Heating

2: NaOH, HCl / toluene / Heating

With hydrogenchloride; sodium hydroxide; potassium carbonate; sodium iodide; In toluene;
DOI:10.1021/ja00314a045

Reference yield:

: 88494-66-0
(S)-(+)-6,7-dichloro-5-methoxy-2-methyl-2-phenyl-1-indanone

: 57297-16-2,57296-63-6
S-(+)-indacrinone

Guidance literature:: Multi-step reaction with 3 steps

1: AlCl₃ / toluene / 45 °C

2: K₂CO₃, NaI / toluene / Heating

3: NaOH, HCl / toluene / Heating

With hydrogenchloride; sodium hydroxide; aluminium trichloride; potassium carbonate; sodium iodide; In toluene;
DOI:10.1021/ja00314a045