2-Methyl-2-propanyl L-valinate hydrochloride (1:1)

Basic Information

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CAS Number

13518-40-6

Molecular Formula

C9H20ClNO2

Molecular Weight

209.72 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Physical Properties

Melting Point

142.0 to 146.0 deg-C

Boiling Point

No data available

Density

2.4480

Flash Point

100℃

Specific Rotation

+5° to +7° (C=2, H2O)

SMILES

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CC(C)C(C(=O)OC(C)(C)C)N.Cl

InChI

InChI=1S/C9H19NO2.ClH/c1-6(2)7(10)8(11)12-9(3,4)5;/h6-7H,10H2,1-5H3;1H/t7-;/m0./s1

InChIKey

AUIVQIHTTVPKFS-FJXQXJEOSA-N

LogP

1.7331999999999999

Topological Polar Surface Area

52.32000000000001 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

158

Safety Information

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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

13518-40-6
L-Valine tert-butyl ester, HCl
L-valine-tert-butyl ester hydrochloride
L-Valine tert-butyl ester HCl
(L)-valine-tert-butyl ester, hydrochloride
(S)-t-butyl 2-amino-3-methylbutanoate hydrochloride
MFCD00034863
Q-101861
AM20080255
H-L-Val-OtBu Hydrochloride
Valine, 1,1-dimethylethyl ester, hydrochloride
(s)-valine t-butyl ester hydrochloride
tert-butyl (2S)-2-amino-3-methylbutanoate hydrochloride
(S)-tert-Butyl 2-amino-3-methylbutanoate hydrochloride
AC-8671
V0097
tert-butyl (2S)-2-amino-3-methylbutanoate;hydrochloride
L-Valine tert-butyl ester hydrochloride
L-Valine t-butyl ester hydrochloride
CS-W019799
tert-butyl (2S)-2-amino-3- methylbutanoate hydrochloride
AKOS015923243
L-Valine t-butyl ester hydrochloride (H-L-Val-OtBu.HCl)
(L)-valine tert-butyl ester hydrochloride
Valine tert-butyl ester hydrochloride
H-Val-OtBu hydrochloride
tert-butyl L-valinate hydrochloride
L-Valine tert-butyl ester hydrochloride, >=99.0%
H-VAL-OTBU HCL
H-Val-OtBu. HCl
HY-Y1030

MDL Number

MFCD00034863

Customs Code

2922499990

FAQ

What is 2-Methyl-2-propanyl L-valinate hydrochloride (CAS: 13518-40-6)?

2-Methyl-2-propanyl L-valinate hydrochloride (CAS: 13518-40-6) is a chemical compound with the molecular formula C9H17NO3HCl. It is a salt form of a valine derivative, characterized by its hydrophilic nature due to the hydrochloride ion.

What are the main uses of 2-Methyl-2-propanyl L-valinate hydrochloride (CAS: 13518-40-6)?

2-Methyl-2-propanyl L-valinate hydrochloride (CAS: 13518-40-6) is primarily used in the pharmaceutical industry as an intermediate in the synthesis of other compounds. It is also utilized in research applications for studying valine derivatives.

Is 2-Methyl-2-proanyl L-valinate hydrochloride (CAS: 13518-40-6) safe?

2-Methyl-2-proanyl L-valinate hydrochloride (CAS: 13518-40-6) is generally safe when handled properly. It is important to follow safety guidelines, including proper ventilation and wearing appropriate personal protective equipment (PPE) to avoid inhalation or skin contact.

How should 2-Methyl-2-proanyl L-valinate hydrochloride (CAS: 13518-40-6) be stored?

2-Methyl-2-proanyl L-valinate hydrochloride (CAS: 13518-40-6) should be stored in a tightly closed container in a cool, dry place away from direct sunlight and heat sources. It is best stored at room temperature (15-25°C) and should be protected from moisture and humidity.