ChemicalBook >> CAS DataBase List >>3-HYDROXYMETHYLINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER

3-HYDROXYMETHYLINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER

CAS No.
96551-22-3
Chemical Name:
3-HYDROXYMETHYLINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
Synonyms
TERT-BUTYL 3-(HYDROXYMETHYL)-1H-INDOLE-1-CARBOXYLATE;Ethanol,7-diazenyl-;Benzene,1-ethenyl-6-nitro-;1-BOC-3-HYDROXYMETHYL-INDOLE;N-BOC-3-(HYDROXYMETHYL)INDOLE;3-(Hydroxymethyl)indole, N-BOC;3-(HYDROXYMETHYL)INDOLE, N-BOC PROTECTED;3-(HYDROXYMETHYL)-1H-INDOLE-1-CARBOXYLATE;t-butyl 3-hydroxymethylindole-1-carboxylate;3-(Hydroxymethyl)-1H-indole, N-BOC protected
CBNumber:
CB4401612
Molecular Formula:
C14H17NO3
Molecular Weight:
247.29
MDL Number:
MFCD05864717
MOL File:
96551-22-3.mol
MSDS File:
SDS
TDS File:
TDS
Last updated:2026-05-28 02:26:40
Product description Number Pack Size Price
3-Hydroxymethylindole-1-carboxylic acid tert-butyl ester Asreported 280130 1g $333
3-Hydroxymethylindole-1-carboxylic acid tert-butyl ester Asreported 280130 2g $463
3-Hydroxymethylindole-1-carboxylic acid tert-butyl ester Asreported 280130 5g $622
3-Hydroxymethylindole-1-carboxylic acid tert-butyl ester Asreported 280130 10g $831
3-Hydroxymethylindole-1-carboxylic acid tert-butyl ester ≥95% 17590 1G $60.39
More product size

3-HYDROXYMETHYLINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER Properties

Boiling point 396.0±34.0 °C(Predicted)
Density 1.14±0.1 g/cm3(Predicted)
storage temp. Sealed in dry,Room Temperature
solubility Chloroform, Dichloromethane
form Solid
pka 14.38±0.10(Predicted)
color Light Brown

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H332-H335
Precautionary statements  P261-P280-P305+P351+P338
Hazard Codes  Xi
HazardClass  IRRITANT
HS Code  2933998090

3-HYDROXYMETHYLINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER price More Price(60)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Usbiological 280130 3-Hydroxymethylindole-1-carboxylic acid tert-butyl ester Asreported 96551-22-3 1g $333 2026-06-03 Buy
Usbiological 280130 3-Hydroxymethylindole-1-carboxylic acid tert-butyl ester Asreported 96551-22-3 2g $463 2026-06-03 Buy
Usbiological 280130 3-Hydroxymethylindole-1-carboxylic acid tert-butyl ester Asreported 96551-22-3 5g $622 2026-06-03 Buy
Usbiological 280130 3-Hydroxymethylindole-1-carboxylic acid tert-butyl ester Asreported 96551-22-3 10g $831 2026-06-03 Buy
Chem-Impex 17590 3-Hydroxymethylindole-1-carboxylic acid tert-butyl ester ≥95% 96551-22-3 1G $60.39 2026-05-19 Buy
Product number Packaging Price Buy
280130 1g $333 Buy
280130 2g $463 Buy
280130 5g $622 Buy
280130 10g $831 Buy
17590 1G $60.39 Buy

3-HYDROXYMETHYLINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER Chemical Properties,Uses,Production

Chemical Properties

3-HYDROXYMETHYLINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER is Light Brown Solid

Uses

3-HYDROXYMETHYLINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER can be used in the preparation of arylpiperidinones for treatment of inflammation.

Synthesis

TERT-BUTYL 3-FORMYL-1H-INDOLE-1-CARBOXYLATE

57476-50-3

3-HYDROXYMETHYLINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER

96551-22-3

Step 2. To a solution of tert-butyl 3-formyl-1H-indole-1-carboxylate (44 g, 0.17 mol) in anhydrous ethanol (50 mL) was added sodium borohydride (16.6 g, 0.45 mol) in batches at 0 °C. The reaction mixture was stirred at room temperature for 3 hours. Upon completion of the reaction, the mixture was filtered to remove insoluble material. The filtrate was rotary evaporated to remove ethanol. The residue was dissolved in ethyl acetate (100 mL) and water (50 mL) for partitioning. The aqueous layer was further extracted with ethyl acetate (2 x 50 mL). The combined organic layers were washed with saturated saline (50 mL), dried over anhydrous sodium sulfate, filtered and concentrated under reduced pressure to give tert-butyl 3-(hydroxymethyl)-1H-indole-1-carboxylate (40 g, 95% yield). The product was characterized by 1H NMR (400 MHz, CDCl3): δ 1.59 (s, 9H), 4.77 (s, 2H), 7.19 (t, 1H), 7.25 (t, 1H), 7.51 (s, 1H), 7.57 (d, 1H), 8.06 (d, 1H).

References

[1] Liebigs Annalen der Chemie, 1985, # 2, p. 413 - 417
[2] Journal of Organic Chemistry, 2016, vol. 81, # 4, p. 1723 - 1730
[3] Chemical and Pharmaceutical Bulletin, 2016, vol. 64, # 8, p. 1242 - 1247
[4] Patent: WO2013/148365, 2013, A1. Location in patent: Paragraph 0083
[5] Synthetic Communications, 2000, vol. 30, # 12, p. 2143 - 2159

3-HYDROXYMETHYLINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER Preparation Products And Raw materials

Global( 99)Suppliers
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Alchem Pharmtech,Inc.
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HANGZHOU LEAP CHEM CO., LTD.
+86-571-87711850 market18@leapchem.com China 43333 58
Sichuan Biosynce Pharmatech Co., Ltd.
+8619950309693 diane@biosynce.com China 4871 58

View Lastest Price from 3-HYDROXYMETHYLINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
1-Boc-3-Hydroxymethylindole pictures 2019-12-23 1-Boc-3-Hydroxymethylindole
96551-22-3
$2.00 1KG ≥98% 100kg Career Henan Chemical Co

3-HYDROXYMETHYLINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER Spectrum

3-HYDROXYMETHYLINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER 3-(HYDROXYMETHYL)INDOLE, N-BOC PROTECTED 3-(Hydroxymethyl)indole, N-BOC protected 98% N-BOC-3-(HYDROXYMETHYL)INDOLE 3-(Hydroxymethyl)-1H-indole, N-BOC protected 3-(Hydroxymethyl)-1H-indole-1-carboxylic acid tert-butyl ester 1-BOC-3-HYDROXYMETHYL-INDOLE 3-(HYDROXYMETHYL)-1H-INDOLE-1-CARBOXYLATE 3-(Hydroxymethyl)indole, N-BOC t-butyl 3-hydroxymethylindole-1-carboxylate 3-HydroxyMethyl-1H-indole-1-carboxylic Acid 1,1-DiMethylethyl Ester tert-Butyl 3-(hydroxyMethyl)indole-1-carboxylate Benzene,1-ethenyl-6-nitro- Ethanol,7-diazenyl- TERT-BUTYL 3-(HYDROXYMETHYL)-1H-INDOLE-1-CARBOXYLATE 96551-22-3 Aromatics Intermediates & Fine Chemicals Pharmaceuticals API intermediates