2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide

Basic Information

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CAS Number

16485-10-2

Molecular Formula

C9H19NO4

Molecular Weight

205.25 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Physical Properties

Melting Point

66-69 °C

Boiling Point

483.6°C at 760 mmHg

Density

1.1660

Water Solubility

Soluble in water, ethanol, ether, chloroform, and propylene glycol.

Flash Point

246.3 °C

Refractive Index

1.501

SMILES

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OCCCNC(=O)C(C(CO)(C)C)O

InChI

InChI=1S/C9H19NO4/c1-9(2,6-12)7(13)8(14)10-4-3-5-11/h7,11-13H,3-6H2,1-2H3,(H,10,14)

InChIKey

SNPLKNRPJHDVJA-UHFFFAOYSA-N

LogP

-1.1355999999999997

Topological Polar Surface Area

89.79 Å²

Hydrogen Bond Donor/Acceptor

4 / 5

Complexity

182

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

H332 Harmful if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Sensitiveness

Hygroscopic

Synonyms & References

English

2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide
(+/-)-pantothenol
dl-pantothenyl alcohol
Panthenol
(+-)-pantothenyl alcohol
D,L-Panthenol
(+/-)-PANTHENOL
(+-)-2,4-Dihydroxy-3,3-dimethyl-buttersaeure-(3-hydroxy-propylamid)
(±)-2,4-Dihydroxy-3,3-dimethylbutyric 3-hydroxypropyl
(±)-α,γ-Dihydroxy-N-(3-hydroxypropyl)-β,β-dimethylbutyramide
2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide
3-(2,4-Dihydroxy-3,3-dimethylbutyramido)-1-propanol
DL-PANTOTHENOL
N-(3-Hydroxy-propyl)-DL-pantamid
N-(3-hydroxy-propyl)-DL-pantamide
pantenol
pantenolo
(+/-)-2,4-Dihydroxy-3,3-dimethylbutyric 3-hydroxypropylamide
PANTOTHENOL
panthenolum
DL- flooding
PANTHENOL,USP
DL-Panthenol
Penthenol
Varitan
d-Pantothenol
Pantenolo [DCIT]
Urupan
Panthenol , DL-form
Alcool DL-pantotenilico
Pantenol [INN-Spanish]

MDL Number

MFCD00002944

FAQ

What is 2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide (CAS: 16485-10-2)?

2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide (CAS: 16485-10-2) is a chemical compound with the molecular formula C9H18O5N. It features a butanamide backbone with hydroxyl groups at positions 2 and 4, and a 3-hydroxypropyl substituent. The compound is characterized by its polar nature, solubility in organic solvents, and potential use as a synthetic intermediate in pharmaceutical and industrial applications.

What are the main uses of 2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide (CAS: 16485-10-2)?

This compound is primarily used in pharmaceutical research as a precursor for drug development, particularly in the synthesis of bioactive molecules. It also finds applications in industrial chemistry for polymer production and as a food additive in flavoring agents. Its unique structure makes it valuable in organic synthesis and chemical research for developing new materials or compounds.

Is 2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide (CAS: 16485-10-2) safe?

2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide (CAS: 16485-10-2) is generally considered safe when handled properly. However, it may cause mild skin or respiratory irritation. Safety precautions include wearing protective gloves, goggles, and ensuring proper ventilation. Always follow safety data sheet guidelines for safe use and exposure limits.

How should 2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide (CAS: 16485-10-2) be stored?

Store 2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide (CAS: 16485-10-2) in a cool, dry, and dark environment to maintain stability. Keep it in a sealed, airtight container away from moisture and incompatible substances. Avoid exposure to high temperatures and direct light to prevent degradation. Proper storage ensures optimal shelf life and safety.