ChemicalBook--->CAS DataBase List--->3130-87-8

3130-87-8

3130-87-8 Structure

3130-87-8 Structure
IdentificationMore
[Name]

DL-Asparagine monohydrate
[CAS]

3130-87-8
[Synonyms]

ASPARAGINE
ASPARAGINE, DL-
DL-2-AMINOSUCCINAMIC ACID
DL-ASPARAGINE
(±)-2-Aminosuccinic acid 4-amide
DL-Aspartic acid 4-amide
Asparagine,99%
DL-2-Aminosuccinamic acid monohydrate~H-DL-Asn.H_2O
DL-Aspraragine Monohydrate
DL-ASPARAGINE MONOHYDRATE CRYSTALLINE
DL-ASPARAGINE 1-HYDRATE
dl-aspargine monohydrate
h-dl-asn.h
ASPARAGINE, DL-(RG)
DL-2-Amino-3-carbamyl-propanoic acid hydrate
DL-2-Aminosuccinamic acid hydrate
DL-Asparagine monohydrate
DL-Aspartic acid 4-amide monohydrate
DL-Asparagine.H2O
H-DL-Asn-OH
[EINECS(EC#)]

221-521-1
[Molecular Formula]

C4H10N2O4
[MDL Number]

MFCD00064400
[Molecular Weight]

150.13
[MOL File]

3130-87-8.mol
Chemical PropertiesBack Directory
[Appearance]

white fine crystalline powder
[Melting point ]

220 °C (dec.)(lit.)
[Boiling point ]

438.0±40.0 °C(Predicted)
[density ]

1.404±0.06 g/cm3(Predicted)
[storage temp. ]

Room Temperature
[solubility ]

Aqueous Acid (Slightly), Water (Slightly)
[form ]

Fine Crystalline Powder
[pka]

2.17(at 20℃)
[color ]

White
[Water Solubility ]

soluble
[BRN ]

6234992
[Major Application]

peptide synthesis
[Cosmetics Ingredients Functions]

FRAGRANCE
SKIN CONDITIONING
HAIR CONDITIONING
ANTISTATIC
[InChI]

1S/C4H8N2O3.H2O/c5-2(4(8)9)1-3(6)7;/h2H,1,5H2,(H2,6,7)(H,8,9);1H2
[InChIKey]

RBMGJIZCEWRQES-UHFFFAOYSA-N
[SMILES]

O.NC(CC(N)=O)C(O)=O
[LogP]

-1.880 (est)
[CAS DataBase Reference]

3130-87-8(CAS DataBase Reference)
[EPA Substance Registry System]

3130-87-8(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

3
[TSCA ]

Yes
[HS Code ]

29241990
[Storage Class]

11 - Combustible Solids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

1,4-Dioxane-->Maleic anhydride
[Preparation Products]

2-[(3-aMino-3-carboxy-propanoyl)aMino]butane-->Z-DL-asparagine-->aspartimide-->Phenylthiohydantoin-aspartic acid
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

DL-Aspartic acid 4-amide monohydrate(3130-87-8).msds
Hazard InformationBack Directory
[Chemical Properties]

white fine crystalline powder
[Uses]

DL-asparagine is a racemic mixture of the non-essential amino acids, L and D-aparagine. It is generally used in growth-media for bacteria-growth. DL-Asparagine monohydrate can also be used to synthesize other salts such as DL-asparaginium perchlorate, DL-asparaginium nitrate and dimethyl DL-aspartate.
[Definition]

ChEBI: An alpha-amino acid in which one of the hydrogens attached to the alpha-carbon of glycine is substituted by a 2-amino-2-oxoethyl group.
[Preparation]

DL-Asparagine monohydrate was synthesized by dissolving maleic anhydride in 1,4-dioxane solution and refluxing with benzylamine after ammonolysis, followed by catalytic hydrogenation.
[reaction suitability]

reaction type: solution phase peptide synthesis
Spectrum DetailBack Directory
[Spectrum Detail]

DL-Asparagine monohydrate(3130-87-8)MS
DL-Asparagine monohydrate(3130-87-8)1HNMR
DL-Asparagine monohydrate(3130-87-8)13CNMR
DL-Asparagine monohydrate(3130-87-8)IR1
DL-Asparagine monohydrate(3130-87-8)IR2
DL-Asparagine monohydrate(3130-87-8)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

DL-Asparagine monohydrate, 98%(3130-87-8)
[Alfa Aesar]

DL-Asparagine monohydrate, 98%(3130-87-8)
[Sigma Aldrich]

3130-87-8(sigmaaldrich)
[TCI AMERICA]

DL-Asparagine  Monohydrate,>99.0%(T)(3130-87-8)
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