2-Methyl-2-propanyl (4-bromo-2-thienyl)carbamate

Basic Information

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CAS Number

868387-45-5

Molecular Formula

C9H12BrNO2S

Molecular Weight

278.17 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

White to Yellow Solid

Boiling Point

279°C at 760 mmHg

Density

1.510

Flash Point

123℃

SMILES

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CC(C)(C)OC(=O)Nc1cc(Br)cs1

InChI

InChI=1S/C9H12BrNO2S/c1-9(2,3)13-8(12)11-7-4-6(10)5-14-7/h4-5H,1-3H3,(H,11,12)

InChIKey

QNGTVGAIEOIQBR-UHFFFAOYSA-N

LogP

3.8576000000000024

Topological Polar Surface Area

38.33 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

217

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

tert-Butyl (4-bromothiophen-2-yl)carbamate
N-(4-Bromo-2-thienyl)-carbamic Acid 1,1-Dimethylethyl Ester
tert-butyl N-(4-bromothiophen-2-yl)carbamate
2-(BOC-AMINO)-4-BROMOTHIOPHENE
tert-butyl 4-bromothiophen-2-ylcarbamate
Carbamic acid, (4-bromo-2-thienyl)-, 1,1-dimethylethyl ester
TERT-BUTYL 4-BROMOTHIEN-2-YLCARBAMATE
QNGTVGAIEOIQBR-UHFFFAOYSA-N
BCP04538
CT0145
PB15153
FCH1382228
VZ33739
TRA0067607
SY021616
tert-Butyl-4-brom

MDL Number

MFCD13195314

Customs Code

2934999090

FAQ

What regulatory guidelines apply to 2-Methyl-2-propanyl (4-bromo-2-thienyl)carbamate (CAS: 868387-45-5)?

2-Methyl-2-propanyl (4-bromo-2-thienyl)carbamate (CAS: 868387-45-5) is subject to the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), which includes hazard communication and safety data sheets. It must comply with the Registration, Evaluation, Authorization, and Restriction of Chemicals (REACH) regulations in the European Union. In the United States, the Food and Drug Administration (FDA) and the Environmental Protection Agency (EPA) have specific requirements for handling and reporting of chemical substances.

Are there alternatives to 2-Methyl-2-propanyl (4-bromo-2-thienyl)carbamate (CAS: 868387-45-5) in synthesis?

Alternative reagents for synthesizing similar compounds include 2-methyl-2-propanyl isothiocyanate and 4-bromothiophene. These can be used as substitutes depending on the specific reaction conditions and desired product. However, the choice of alternative reagents should be based on the reactivity and availability, as well as the need to meet regulatory and safety requirements.

What is the market or research trend for 2-Methyl-2-propanyl (4-bromo-2-thienyl)carbamate (CAS: 868387-45-5)?

The market for 2-Methyl-2-propanyl (4-bromo-2-thienyl)carbamate (CAS: 868387-45-5) is primarily focused on its use as a precursor in the synthesis of other organic molecules. Recent research trends include its application in medicinal chemistry and pharmaceuticals. Market trends indicate an increasing demand for high-quality, pure chemicals that meet stringent regulatory standards.

How should waste containing 2-Methyl-2-propanyl (4-bromo-2-thienyl)carbamate (CAS: 868387-45-5) be handled?

Waste containing 2-Methyl-2-propanyl (4-bromo-2-thienyl)carbamate (CAS: 868387-45-5) should be collected in appropriate containers lined with impermeable materials to prevent leakage. It should be disposed of through a licensed hazardous waste management facility. Incineration or professional waste disposal methods should be used, and environmental protection measures such as proper ventilation and safety equipment should be maintained to prevent contamination and ensure worker safety.