5-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid

Basic Information

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CAS Number

165947-48-8

Molecular Formula

C13H17NO4S

Molecular Weight

283.35 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

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

White to Yellow Solid

Boiling Point

453.2℃ at 760 mmHg

SMILES

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CC(C)(C)OC(=O)N1CCC2=C(C1)C=C(S2)C(=O)O

InChI

InChI=1S/C13H17NO4S/c1-13(2,3)18-12(17)14-5-4-9-8(7-14)6-10(19-9)11(15)16/h6H,4-5,7H2,1-3H3,(H,15,16)

InChIKey

VYACEHZLOWZZEV-UHFFFAOYSA-N

LogP

2.7395000000000005

Topological Polar Surface Area

66.84 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

379

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

5-[(2-methylpropan-2-yl)oxycarbonyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-2-carboxylic acid
PB11831
5-(BOC)-4,5,6,7-Tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid
5-t-Butoxycarbonyl-4,5,6,7-tetrahydro-thieno[3,2-c]pyridine-2-carboxylic acid
AKOS005264179
EN300-301498
5-(TERT-BUTOXYCARBONYL)-4 pound not5 pound not6 pound not7-TETRAHYDROTHIENO[3 pound not2-C]PYRIDINE-2-CARBOXYLICACID
5-(tert-Butoxycarbonyl)-4,5,6,7-tetrahydrothieno-[3,2-c]pyridine-2-carboxylic acid
SC2871
5-tert-butoxycarbonyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid
FT-0643591
AM20080469
5-(tert-butoxycarbonyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid
5-Boc-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid
thieno[3,2-c]pyridine-2,5(4H)-dicarboxylic acid, 6,7-dihydro-, 5-(1,1-dimethylethyl) ester
DL-3-TERT-BUTOXY-N-CARBOXYALANINE,N-BENZYLESTER
CS-W006800
Z1505716631
VYACEHZLOWZZEV-UHFFFAOYSA-N
DTXSID40590490
5-[(tert-butoxy)carbonyl]-4H,5H,6H,7H-thieno[3,2-c]pyridine-2-carboxylic acid
DS-10816
5-(tert-butoxycarbonyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylicacid
5-t-butoxycarbonyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-carboxylic acid
5-tert-butoxycarbonyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-carboxylic acid
A3679
W-205951
MFCD08448165
SCHEMBL743782
165947-48-8
5-(tert-Butoxycarbonyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid

MDL Number

MFCD08448165

Customs Code

2934999090

FAQ

What is 5-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid (CAS: 165947-48-8)?

5-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid is a complex organic compound with a thienopyridine structure. It has a molecular weight of approximately 392.45 g/mol and is characterized by its unique electronic and structural properties.

What are the main uses of 5-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid (CAS: 165947-48-8)?

This compound is primarily used in pharmaceutical research due to its potential biological activity. It may be employed as a starting material for the synthesis of more complex molecules or as a drug candidate itself.

Is 5-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid (CAS: 165947-48-8) safe?

While this compound is generally safe under normal conditions, it is important to follow safety guidelines. Wear appropriate personal protective equipment (PPE) such as gloves and goggles. Store in a cool, dry place away from heat sources and direct sunlight. Avoid inhaling dust or fumes.

How should 5-{[(2-Methyl-2-propanyl)oxy]carbonyl}-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylic acid (CAS: 165947-48-8) be stored?

This compound should be stored in a tightly sealed container at room temperature or slightly below. Keep it away from heat, sparks, and direct sunlight. Ensure good ventilation in the storage area. Do not store in high humidity environments or near incompatible materials such as acids or oxidizers.