(3S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid

Basic Information

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CAS Number

74163-81-8

Molecular Formula

C10H11NO2

Molecular Weight

177.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

>300 °C

Boiling Point

309.12°C (rough estimate)

Density

1.1607 (rough estimate)

Flash Point

178.8℃

Refractive Index

-166 ° (C=1, 1mol/L NaOH)

Specific Rotation

-157.4 º (24 ºC)

SMILES

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C1C(NCC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C10H11NO2/c12-10(13)9-5-7-3-1-2-4-8(7)6-11-9/h1-4,9,11H,5-6H2,(H,12,13)/t9-/m0/s1

InChIKey

BWKMGYQJPOAASG-VIFPVBQESA-N

LogP

0.7855000000000001

Topological Polar Surface Area

49.33 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

205

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

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

3-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-, (3S)-
L-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid
S-(-)-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid
737G46U1NP
(-)-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid
1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID, (3S)-
Z762926698
CHEMBL447576
TS-02454
MFCD00144533
HY-I0422
H-TIC-OH
(S)-1,2,3,4-Tetrahydro-3-isoquinoline-carboxylic acid
BWKMGYQJPOAASG-VIFPVBQESA-N
(3s)-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid
(S)-(-)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid
1,2,3,4-TETRAHYDROISOQUINOLINE-3-CARBOXYLIC ACID, (-)-
(S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid, 97%
74163-81-8
AM20060719
NS00120557
(3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
T1515
Q27266148
J-650310
UNII-737G46U1NP
Quinapril Hydrochloride Imp. A (EP); Quinapril Imp. A (EP); (3S)-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic Acid; Quinapril Hydrochloride Impurity A; Quinapril Impurity A
A9522
1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid, (S)-
QUINAPRIL HYDROCHLORIDE IMPURITY A [EP IMPURITY]
SCHEMBL288272

MDL Number

MFCD00144533

Customs Code

2933499090

FAQ

What is (3S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid (CAS: 74163-81-8)?

(3S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid, with the CAS number 74163-81-8, is a chiral compound belonging to the class of isoquinoline derivatives. It has the chemical formula C10H13NO2 and is known for its structural similarity to other pharmacologically active substances. This compound is characterized by its hydrophilic nature and potential biological activity, making it relevant in various research fields.

What are the main uses of (3S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid (CAS: 74163-81-8)?

(3S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid (CAS: 74163-81-8) is primarily used in pharmaceutical research for the development of drugs targeting central nervous system disorders. It also finds applications in organic synthesis and as a potential inhibitor in biochemical studies. Its role in medicinal chemistry is significant due to its structural features and possible pharmacological effects.

Is (3S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid (CAS: 74163-81-8) safe?

The safety of (3S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid (CAS: 74163-81-8) depends on its application and exposure conditions. As a chemical compound, it should be handled with appropriate personal protective equipment (PPE) such as gloves and goggles. Safety data sheets (SDS) should be consulted for detailed handling and disposal guidelines to ensure compliance with chemical safety standards.

How should (3S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid (CAS: 74163-81-8) be stored?

(3S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid (CAS: 74163-81-8) should be stored in a cool, dry, and dark place, away from moisture and light. It is recommended to keep it in a sealed container at a temperature below 25°C to maintain stability. Proper storage is essential to prevent degradation and ensure its integrity for future use.