Isocarbostyril CAS NO.491-30-5

Product Name:    Isocarbostyril
Synonyms:    ISOCARBOSTYRIL;ISOQUINOLIN-1(2H)-ONE;ISOQUINOLIN-1-OL;1-Hydroxyisoquinoline,97%;Isocarbostyril (VAN) (8CI);Isoquinolin-1-one;Isocarbostyril 98%;isoquinolin-1(2H)-one analogue
CAS:    491-30-5
MF:    C9H7NO
MW:    145.16
EINECS:    207-732-1
Mol File:    491-30-5.mol
             

Isocarbostyril Chemical Properties
Melting point     212-216 °C
Boiling point     376.3±35.0 °C(Predicted)
density     1.188±0.06 g/cm3(Predicted)
storage temp.     Inert atmosphere,Room Temperature
pka    13.62±0.20(Predicted)
form     Powder or Crystalline Powder
color     White to pale brown
BRN     2954
InChIKey    VDBNYAPERZTOOF-UHFFFAOYSA-N
CAS DataBase Reference    491-30-5(CAS DataBase Reference)
Safety Information
Risk Statements     36/37/38
Safety Statements     22-24/25-37-26
WGK Germany     3
TSCA     N
HS Code     29334900
MSDS Information
Provider    Language
SigmaAldrich    English
Isocarbostyril Usage And Synthesis
Chemical Properties    Yellow Solid
Synthesis Reference(s)    Journal of Heterocyclic Chemistry, 27, p. 1419, 1990 DOI: 10.1002/jhet.5570270544
The Journal of Organic Chemistry, 21, p. 1337, 1956 DOI: 10.1021/jo01118a001
Synthesis, p. 791, 1983 DOI: 10.1055/s-1983-30513
Isocarbostyril Preparation Products And Raw materials
Raw materials    1-Chloroisoquinoline-->N-(pivaloyloxy)benzamide-->Benzamide, 2-ethenyl- (9CI)-->3-HYDROXYISOINDOLIN-1-ON-->Naphthalen-1,4-iMine-9-carboxylic acid, 1,4-dihydro-, 1,1-diMethylethyl ester-->methyl 2-((trimethylsilyl)ethynyl)benzoate-->N-MethoxybenzaMide-->N-VINYLFORMAMIDE-->Isoquinoline-->Vinyl acetate-->Benzoic acid
Preparation Products    α-Oxobenzeneacetamide-->N-PHENYLCARBAMIC ACID METHYL ESTER-->Isoquinolin-4-ol-->ISOQUINOLINE-1-CARBALDEHYDE-->1-Bromoisoquinoline