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ChemicalBook >> CAS DataBase List >>1-BOC-4-BROMO-1H-INDAZOLE

1-BOC-4-BROMO-1H-INDAZOLE

CAS No.
926922-37-4
Chemical Name:
1-BOC-4-BROMO-1H-INDAZOLE
Synonyms
tert-butyl 4-bromo-1H-indazole-1-carboxylate;1-BOC-4-BROMO-1H-INDAZOLE;4-Bromoindazole-1-carboxylic;4-Bromo-1H-indazole, N1-BOC protected;tert-butyl 4-bromoindazole-1-carboxylate;4-Bromoindazole-1-carboxylic acid tert-butyl ester;1,1-Dimethylethyl 4-bromo-1H-indazole-1-carboxylate;4-Bromo-1H-indazole-1-carboxylic acid tert-butyl ester;1H-INDAZOLE-1-CARBOXYLIC ACID,4-BROMO-,1,1-DIMETHYLETHYL ESTER
CBNumber:
CB02456063
Molecular Formula:
C12H13BrN2O2
Molecular Weight:
297.15
MDL Number:
MFCD11110271
MOL File:
926922-37-4.mol
MSDS File:
SDS
TDS File:
TDS
Last updated:2026-05-27 22:30:02
Product description Number Pack Size Price
1-Boc-4-bromo-1H-indazole Asreported 266168 50mg $343
1-Boc-4-bromo-1H-indazole Asreported 266168 100mg $472
1-Boc-4-bromo-1H-indazole Asreported 266168 250mg $569
1-Boc-4-bromo-1H-indazole Asreported 266168 500mg $751
1-Boc-4-bromo-1H-indazole Asreported 266168 1g $1117
More product size

1-BOC-4-BROMO-1H-INDAZOLE Properties

Boiling point 377.4±34.0 °C(Predicted)
Density 1.46±0.1 g/cm3(Predicted)
storage temp. 2-8°C
pka -2.73±0.30(Predicted)
Appearance White to off-white Solid
InChI InChI=1S/C12H13BrN2O2/c1-12(2,3)17-11(16)15-10-6-4-5-9(13)8(10)7-14-15/h4-7H,1-3H3
InChIKey OFVPGIHEBLOESV-UHFFFAOYSA-N
SMILES N1(C(OC(C)(C)C)=O)C2=C(C(Br)=CC=C2)C=N1

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
HS Code  2933998090

1-BOC-4-BROMO-1H-INDAZOLE price More Price(47)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Usbiological 266168 1-Boc-4-bromo-1H-indazole Asreported 926922-37-4 50mg $343 2026-06-03 Buy
Usbiological 266168 1-Boc-4-bromo-1H-indazole Asreported 926922-37-4 100mg $472 2026-06-03 Buy
Usbiological 266168 1-Boc-4-bromo-1H-indazole Asreported 926922-37-4 250mg $569 2026-06-03 Buy
Usbiological 266168 1-Boc-4-bromo-1H-indazole Asreported 926922-37-4 500mg $751 2026-06-03 Buy
Usbiological 266168 1-Boc-4-bromo-1H-indazole Asreported 926922-37-4 1g $1117 2026-06-03 Buy
Product number Packaging Price Buy
266168 50mg $343 Buy
266168 100mg $472 Buy
266168 250mg $569 Buy
266168 500mg $751 Buy
266168 1g $1117 Buy

1-BOC-4-BROMO-1H-INDAZOLE Chemical Properties,Uses,Production

Synthesis

Di-tert-butyl dicarbonate

24424-99-5

4-Bromo-1H-indazole

186407-74-9

1-BOC-4-BROMO-1H-INDAZOLE

926922-37-4

At room temperature, 4-bromo-1H-indazole (1.0 g, 5.07 mmol) was dissolved in dichloromethane (DCM, 20 mL), followed by sequential addition of triethylamine (TEA, 0.85 mL, 6.1 mmol) and 4-dimethylaminopyridine (DMAP, 0.062 g, 0.50 mmol). Di-tert-butyl dicarbonate (Boc anhydride, 1.28 mL, 5.58 mmol) was added slowly and dropwise to the reaction mixture under continuous stirring. The reaction mixture was continued to be stirred at room temperature for 2.5 hours. Upon completion of the reaction, the mixture was poured into water (30 mL) and extracted with dichloromethane (2 x 30 mL). The organic phases were combined, dried over anhydrous sodium sulfate (Na2SO4), filtered and concentrated under reduced pressure. The crude product was purified by fast column chromatography (eluent: hexane solution of 15-20% ethyl acetate) to afford the target compound tert-butyl 4-bromo-1H-indazole-1-carboxylate (1.5 g, 5.06 mmol). The product was analyzed by LCMS (Method C) showing a retention time of 2.601 min and a mass spectrum (MS: ES+) m/z of 297.19; NMR hydrogen spectrum (400 MHz, DMSO-d6) δ ppm: 8.20 (s, 1H), 8.15 (d, J = 8.0 Hz, 1H), 7.47 (dd, J = 0.8 Hz, 7.6 Hz. 1H), 7.37-7.41 (m, 1H), 1.74 (s, 9H).

References

[1] Patent: WO2007/21937, 2007, A2. Location in patent: Page/Page column 42
[2] Patent: WO2017/109488, 2017, A1. Location in patent: Page/Page column 43

1-BOC-4-BROMO-1H-INDAZOLE Preparation Products And Raw materials

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1-BOC-4-BROMO-1H-INDAZOLE Spectrum

1-BOC-4-BROMO-1H-INDAZOLE 1H-INDAZOLE-1-CARBOXYLIC ACID,4-BROMO-,1,1-DIMETHYLETHYL ESTER 4-Bromo-1H-indazole-1-carboxylic acid tert-butyl ester 4-Bromoindazole-1-carboxylic acid tert-butyl ester 4-Bromo-1H-indazole, N1-BOC protected tert-butyl 4-bromoindazole-1-carboxylate 4-Bromoindazole-1-carboxylic 1,1-Dimethylethyl 4-bromo-1H-indazole-1-carboxylate tert-butyl 4-bromo-1H-indazole-1-carboxylate 926922-37-4
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