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2(1H)-Isoquinolinecarboxylic acid, 1-(1,1-dimethylethoxy)-, 1,1-dimethylethyl ester

Boc-1-tert-butoxy-1,2-dihydroisoquinoline

CAS: 404586-94-3

Molecular Formula: C18H25NO3

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2(1H)-Isoquinolinecarboxylic acid, 1-(1,1-dimethylethoxy)-, 1,1-dimethylethyl ester - Names and Identifiers

Name Boc-1-tert-butoxy-1,2-dihydroisoquinoline
Synonyms BBDI
Boc-1-tert-butoxy-1,2-dihydroisoquinoline
tert-Butyl 1-(tert-butoxy)isoquinoline-2(1H)-carboxylate
1-tert-Butoxy-2-butoxycarbonyl-1,2-dihydroisoquinoline, BBDI
2(1H)-Isoquinolinecarboxylic acid, 1-(1,1-dimethylethoxy)-, 1,1-dimethylethyl ester
CAS 404586-94-3

2(1H)-Isoquinolinecarboxylic acid, 1-(1,1-dimethylethoxy)-, 1,1-dimethylethyl ester - Physico-chemical Properties

Molecular FormulaC18H25NO3
Molar Mass303.4
Density1.09±0.1 g/cm3(Predicted)
Melting Point112-116 °C
Boling Point412.9±45.0 °C(Predicted)
pKa-2.58±0.40(Predicted)

2(1H)-Isoquinolinecarboxylic acid, 1-(1,1-dimethylethoxy)-, 1,1-dimethylethyl ester - Risk and Safety

Risk CodesR25 - Toxic if swallowed
R36/37/38 - Irritating to eyes, respiratory system and skin.
R50/53 - Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. 
R22 - Harmful if swallowed
Safety DescriptionS26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37 - Wear suitable protective clothing and gloves.
S45 - In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
S60 - This material and its container must be disposed of as hazardous waste.
S61 - Avoid release to the environment. Refer to special instructions / safety data sheets. 
UN IDsUN 2811 6.1/PG 3
WGK Germany3

2(1H)-Isoquinolinecarboxylic acid, 1-(1,1-dimethylethoxy)-, 1,1-dimethylethyl ester - Upstream Downstream Industry

Downstream ProductsTERT-BUTYL 4-CYANOPHENYLCARBAMATE

2(1H)-Isoquinolinecarboxylic acid, 1-(1,1-dimethylethoxy)-, 1,1-dimethylethyl ester - Introduction

Boc-1-tert-butoxy-1,2-dihydroisoquinoline is an organic compound with the formula C14H21NO2. It mainly has the following properties:

1. Appearance: Boc-1-tert-butoxy-1,2-dihydroisoquinoline is common as a white or white-like solid.

2. Solubility: It is soluble in many organic solvents, such as chloroform, dichloromethane and ethyl acetate.

3. Melting point: Boc-1-tert-butoxy-1, the melting point of 2-dihydroisoquinoline is about 60-63 degrees Celsius.

Boc-1-tert-butoxy-1,2-dihydroisoquinoline is commonly used as an intermediate or reagent in organic synthesis. It can be used to prepare compounds containing a dihydroisoquinoline nucleus, such as pharmaceuticals and natural products. It can also be used to synthesize biologically active compounds, such as anti-tumor drugs.

the method of preparing Boc-1-tert-butoxy-1,2-dihydroisoquinoline can be obtained by adding sodium nitrite to isoquinoline, then adding tert-butyl ammonium bromide under alkaline conditions, reacting to form the corresponding nitrite intermediate, and finally reacting with tert-butyl hydroxyformate to generate the target product.

For safety information, Boc-1-tert-butoxy-1, the specific toxicity data of 2-dihydroisoquinoline may be limited, so the following matters should be paid attention to when using it:

1. Protective measures: When touching or operating Boc-1-tert-butoxy-1,2-dihydroisoquinoline, you should wear appropriate personal protective equipment, such as laboratory gloves and protective glasses.

2. Inhalation risk: Avoid inhaling Boc-1-tert-butoxy-1,2-dihydroisoquinoline dust or gas. Operate in a well-ventilated environment if necessary.

3. skin contact: avoid Boc-1-tert-butoxy-1,2-dihydroisoquinoline contact with skin, so as not to cause irritation or allergic reaction. In case of contact, flush immediately with plenty of water and seek medical help.

Please note that this is an overview based on common information provided, specific use and handling should follow the specific compound and laboratory safety practices.
Last Update:2024-04-09 21:21:28
Supplier List
Suzhou Haofan biological Co., Ltd.
Product Name: BBDI Request for quotation
CAS: 404586-94-3
Tel: +86 0512-68417696
Email: chenmengqi@highfine.com
     wuhao@highfine.com
     merry@highfine.com
QQ: 4006286883 Click to send a QQ message
Shanghai Macklin Biochemical Co., Ltd
Spot supply
Product Name: Boc-1-tert-butoxy-1,2-dihydroisoquinoline Visit Supplier Webpage Request for quotation
CAS: 404586-94-3
Tel: +86-18821248368
Email: Int06@meryer.com
Mobile: +86-18821248368
QQ: 495145328 Click to send a QQ message
WhatsApp: +86-18821248368
Suzhou Haofan biological Co., Ltd.
Product Name: BBDI Request for quotation
CAS: 404586-94-3
Tel: +86 0512-68417696
Email: chenmengqi@highfine.com
     wuhao@highfine.com
     merry@highfine.com
QQ: 4006286883 Click to send a QQ message
Shanghai Macklin Biochemical Co., Ltd
Spot supply
Product Name: Boc-1-tert-butoxy-1,2-dihydroisoquinoline Visit Supplier Webpage Request for quotation
CAS: 404586-94-3
Tel: +86-18821248368
Email: Int06@meryer.com
Mobile: +86-18821248368
QQ: 495145328 Click to send a QQ message
WhatsApp: +86-18821248368
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Downstream Products for 2(1H)-Isoquinolinecarboxylic acid, 1-(1,1-dimethylethoxy)-, 1,1-dimethylethyl ester
TERT-BUTYL 4-CYANOPHENYLCARBAMATE
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