(3S)-3-Amino-3-(3-hydroxyphenyl)propanoic acid

Basic Information

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CAS Number

695149-42-9

Molecular Formula

C9H11NO3

Molecular Weight

181.19 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

SMILES

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C1=CC(=CC(=C1)O)C(CC(=O)O)N

InChI

InChI=1S/C9H11NO3/c10-8(5-9(12)13)6-2-1-3-7(11)4-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1

InChIKey

NYHNEKBZZXSUNO-QMMMGPOBSA-N

LogP

0.8666999999999998

Topological Polar Surface Area

83.55 Å²

Hydrogen Bond Donor/Acceptor

4 / 4

Complexity

184

Synonyms & References

English

h-beta-phe(3-oh)-oh
H-D-Phg(3-OH)-(C#CH2)OH
695149-42-9
SCHEMBL3874627
(S)-3-Amino-3-(3-hydroxy-phenyl)-propionicacid
DTXSID60353322
VCB14942
MFCD04113690
S-3-Amino-3-(3-hydroxy-phenyl)-propionic acid
AC-25419
AKOS017344562
(S)-3-AMINO-3-(3-HYDROXYPHENYL)PROPANOIC ACID
AS-37897
(s)-3-(3-hydroxyphenyl)-beta-alanine
A836523
(S)-3-Amino-3-93-hydroxy-phneyl)-propionic acid
Benzenepropanoic acid, b-amino-3-hydroxy-, (bS)-
(s)-3-amino-3-(3-hydroxy-phenyl)-propionic acid
(S)-beta-(3-Hydroxyphenyl)alanine
(s)-3-amino-3-(3-hydroxy-phenyl)-propanoic acid
h-d-phg(3-oh)-(c*ch2)oh
(s)-3-amino-3-(3-hydroxyphenyl)propionic acid
(S)-3-AMINO-3-(3-HYDROXYPHENYL)PROPANOICACID
(3s)-3-amino-3-(3-hydroxyphenyl)propanoic acid
CS-0197374
(S)-3-Amino-3-(3-hydroxyphenyl)propionic acid
(S)-3-Amino-3-(3-hydroxyphenyl)-propionic acid
(S)-beta-(3-hydroxyphenyl)alanine

MDL Number

MFCD04113690

FAQ

What is (3S)-3-Amino-3-(3-hydroxyphenyl)propanoic acid (CAS: 695149-42-9)?

(3S)-3-Amino-3-(3-hydroxyphenyl)propanoic acid, also known as 3-aminovanillyl alcohol, is an organic compound with the CAS number 695149-42-9. It has a molecular formula of C9H13NO3 and a molecular weight of 183.23 g/mol. This compound is characterized by its amine and phenolic groups, which contribute to its basic and acidic properties, respectively.

What are the main uses of (3S)-3-Amino-3-(3-hydroxyphenyl)propanoic acid (CAS: 695149-42-9)?

(3S)-3-Amino-3-(3-hydroxyphenyl)propanoic acid is primarily used in the pharmaceutical industry as a precursor for vanilloid receptor agonists. It is also utilized in research as a tool compound to study vanilloid receptors and in the development of analgesic drugs. Additionally, it can be found in some food additives and flavorings.

Is (3S)-3-Amino-3-(3-hydroxyphenyl)propanoic acid (CAS: 695149-42-9) safe?

The safety of (3S)-3-Amino-3-(3-hydroxyphenyl)propanoic acid (CAS: 695149-42-9) depends on its intended use and exposure level. It is generally considered safe for industrial use and in low concentrations in food additives. However, it should be handled with care, especially by avoiding contact with skin and eyes. Proper ventilation and protective equipment are recommended during handling.

How should (3S)-3-Amino-3-(3-hydroxyphenyl)propanoic acid (CAS: 695149-42-9) be stored?

(3S)-3-Amino-3-(3-hydroxyphenyl)propanoic acid should be stored in a cool, dry place away from direct sunlight and heat sources to maintain its stability. It is best kept in a tightly sealed container to prevent moisture absorption. The storage temperature should ideally be below 25°C (77°F) to ensure optimal conditions for long-term storage.