2-Amino-2-[2-(4-octylphenyl)ethyl]-1,3-propanediol hydrochloride (1:1)

Basic Information

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CAS Number

162359-56-0

Molecular Formula

C19H34ClNO2

Molecular Weight

343.94 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

Powder

Melting Point

102-107°C

Solubility

water: soluble10mg/mL, clear

SMILES

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CCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)N.Cl

InChI

InChI=1S/C19H33NO2.ClH/c1-2-3-4-5-6-7-8-17-9-11-18(12-10-17)13-14-19(20,15-21)16-22;/h9-12,21-22H,2-8,13-16,20H2,1H3;1H

InChIKey

SWZTYAVBMYWFGS-UHFFFAOYSA-N

LogP

3.626100000000002

Topological Polar Surface Area

66.48 Å²

Hydrogen Bond Donor/Acceptor

4 / 3

Complexity

258

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H361 Suspected of damaging fertility or the unborn child
Reproductive toxicity

Toxicity

LD50 orally in rats: 300-600 mg/kg (Troncoso)

Synonyms & References

English

HY-12005
2-Amino-2-(2-(4-octylphenyl)ethyl)-1,3-propanediol hydrochloride
MFCD00939512
FT-0643569
BCP9000705
162359-56-0
Fingolimod hydrochloride [USAN]
[1-hydroxy-2-(hydroxymethyl)-4-(4-octylphenyl)butan-2-yl]azanium;chloride
2-Amino-2-[2-(4-octylphenyl)-ethyl]-1,3-propanediol hydrochloride
G926EC510T
A25158
D04187
DTXCID5089855
2-(4-octylphenethyl)-2-aminopropane-1,3-diol hydrochloride
FTY-720A
FINGOLIMOD HYDROCHLORIDE [USP MONOGRAPH]
Fingolimod hydrochloride- Bio-X
SW219384-1
Fingolimod (as hydrochloride)
CCG-265016
FINGOLIMOD HYDROCHLORIDE [WHO-DD]
1,3-Propanediol, 2-amino-2-[2-(4-octylphenyl)ethyl]-, hydrochloride (1:1)
MLS006010179
SY057854
BCP01808
FINGOLIMOD HYDROCHLORIDE [ORANGE BOOK]
Fingolimod hydrochloride (JAN/USAN)
Fingolimod (FTY720) HCl
Q27132395
Fingolimod hydrochlorid
AM84549

MDL Number

MFCD00939512

Customs Code

2922199090

FAQ

What is 2-Amino-2-[2-(4-octylphenyl)ethyl]-1,3-propanediol hydrochloride (1:1) (CAS: 162359-56-0)?

2-Amino-2-[2-(4-octylphenyl)ethyl]-1,3-propanediol hydrochloride (1:1) is a chemical compound with the CAS number 162359-56-0. It is a hydrochloride salt of 2-amino-2-[2-(4-octylphenyl)ethyl]-1,3-propanediol, which is characterized by its amphoteric nature, solubility in water, and potential applications in various industries. The compound is commonly used as an intermediate in chemical synthesis due to its functional groups and structural versatility.

What are the main uses of 2-Amino-2-[2-(4-octylphenyl)ethyl]-1,3-propanediol hydrochloride (1:1) (CAS: 162359-56-0)?

2-Amino-2-[2-(4-octylphenyl)ethyl]-1,3-propanediol hydrochloride (1:1) (CAS: 162359-56-0) is primarily used as an intermediate in pharmaceutical and chemical synthesis. It finds applications in the development of drugs, as a component in polymer materials, and in research settings where functionalized compounds are required. Its unique structure makes it valuable for creating derivatives with specific biological or chemical properties.

Is 2-Amino-2-[2-(4-octylphenyl)ethyl]-1,3-propanediol hydrochloride (1:1) (CAS: 162359-56-0) safe?

2-Amino-2-[2-(4-octylphenyl)ethyl]-1,3-propanediol hydrochloride (1:1) (CAS: 162359-56-0) is generally considered safe when handled properly. However, as with many chemical compounds, it should be used with appropriate protective measures, such as gloves and goggles, to avoid skin or eye contact. Safety data sheets (SDS) should be consulted for specific handling and disposal guidelines to ensure compliance with safety standards and regulations.

How should 2-Amino-2-[2-(4-octylphenyl)ethyl]-1,3-propanediol hydrochloride (1:1) (CAS: 162359-56-0) be stored?

2-Amino-2-[2-(4-octylphenyl)ethyl]-1,3-propanediol hydrochloride (1:1) (CAS: 162359-56-0) should be stored in a cool, dry, and well-ventilated place, away from direct light. It is recommended to keep it in a sealed container to prevent moisture absorption and maintain stability. Storage conditions should be controlled to ensure the compound remains chemically intact and safe for use.