1-(4-Hydroxybenzyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol hydrochloride (1:1)

Basic Information

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CAS Number

11041-94-4

Molecular Formula

C16H18ClNO3

Molecular Weight

307.78 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

Powder

Boiling Point

522.4°C at 760 mmHg

Flash Point

209.6°C

Solubility

N/A

SMILES

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C1CNC(C2=CC(=C(C=C21)O)O)CC3=CC=C(C=C3)O.Cl

InChI

InChI=1S/C16H17NO3.ClH/c18-12-3-1-10(2-4-12)7-14-13-9-16(20)15(19)8-11(13)5-6-17-14;/h1-4,8-9,14,17-20H,5-7H2;1H

InChIKey

SWWQQSDRUYSMAR-UHFFFAOYSA-N

LogP

2.654700000000001

Topological Polar Surface Area

72.72 Å²

Hydrogen Bond Donor/Acceptor

4 / 4

Complexity

317

Safety Information

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Storage Conditions

2-8℃

Synonyms & References

English

11041-94-4
MFCD01717353
PQ432PID6E
DTXSID10911673
6 pound not7-Dihydroxy-1-(4-Hydroxybenzyl)-1 pound not2 pound not3 pound not4-tetrahydroisoquinoline Hydrochloride
11041-94-4 (HCl)
Higenamine?Hydrochloride
J-503750
EN300-822191
_x000D_67-Dihydroxy-1-(4-Hydroxybenzyl)-1234-tetrahydroisoquinoline Hydrochloride
Higenamine hydrochloride
1ST40288A
AS-10415
XH163199
1,2,3,4-Tetrahydro-1-((4-hydroxyphenyl)methyl)-6,7-isoquinolinediol hydrochloride
6,7-ISOQUINOLINEDIOL, 1,2,3,4-TETRAHYDRO-1-((4-HYDROXYPHENYL)METHYL)-, HYDROCHLORIDE (1:1)
UNII-PQ432PID6E
FT-0696741
Q27286703
CCG-267555
6,7-dihydroxy-1-(4-hydroxybenzyl)-1,2,3,4-tetrahydroisoquinoline hydrochloride
(+/-)-DEMETHYLCOCLAURINE HYDROCHLORIDE
1-[(4-Hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol--hydrogen chloride (1/1)
(+/-)-Higenamine HCl - natural
(+-)-Demethylcoclaurine hydrochloride
BCP07397
Demethylcoclaurine hydrochloride
1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol;hydrochloride
s3960
Higenamine (hydrochloride)
6,7-ISOQUINOLINEDIOL, 1,2,3,4-TETRAHYDRO-1-((4-HYDROXYPHENYL)METHYL)-, HYDROCHLORIDE, (+/-)-

MDL Number

MFCD01717353

Customs Code

2933499090

FAQ

What is 1-(4-Hydroxybenzyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol hydrochloride (1:1) (CAS: 11041-94-4)?

1-(4-Hydroxybenzyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol hydrochloride (1:1) is a chemical compound with the CAS number 11041-94-4. It is a hydrochloride salt of a tetrahydroisoquinoline derivative, characterized by its molecular structure containing a hydroxybenzyl group and two hydroxyl groups on the isoquinoline ring. This compound is commonly used in pharmaceutical research due to its potential biological activities, including antioxidant and anti-inflammatory properties.

What are the main uses of 1-(4-Hydroxybenzyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol hydrochloride (1:1) (CAS: 11041-94-4)?

1-(4-Hydroxybenzyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol hydrochloride (1:1) is primarily used in pharmaceutical research for its potential therapeutic applications. It has been studied for its antioxidant and anti-inflammatory properties, making it relevant in drug development for conditions such as oxidative stress and inflammation. Additionally, it may find use in biochemical studies and as a precursor in synthetic chemistry.

Is 1-(4-Hydroxybenzyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol hydrochloride (1:1) (CAS: 11041-94-4) safe?

The safety of 1-(4-Hydroxybenzyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol hydrochloride (1:1) (CAS: 11041-94-4) depends on its handling and application. As a research chemical, it is generally considered safe when used in controlled environments with proper protective measures. However, it is important to follow standard laboratory safety protocols, including use of gloves, goggles, and a fume hood, to minimize exposure and ensure safe handling. Long-term toxicity data may be limited, so caution is advised.

How should 1-(4-Hydroxybenzyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol hydrochloride (1:1) (CAS: 11041-94-4) be stored?

1-(4-Hydroxybenzyl)-1,2,3,4-tetrahydro-6,7-isoquinolinediol hydrochloride (1:1) (CAS: 11041-94-4) should be stored in a cool, dry, and dark place to maintain its stability. It is best kept in a sealed container at a temperature below 25°C and away from moisture and direct light. Proper storage is essential to prevent degradation and ensure the compound remains effective for research or pharmaceutical purposes.