2-(Methylamino)isobuttersaeure

alpha-(Methylamino)isobutyric acid

HCID 75725

Grundinformationen

CAS
2566-34-9
Standard-SMILES
CNC(C)(C)C(=O)O
InChIKey
DLAMVQGYEVKIRE-UHFFFAOYSA-N
Summenformel
C5H11NO2
Durchschnittliche Molmasse
117,15 g/mol
Monoisotopische Masse
117,07897859

Überblick

Alpha-(methylamino)isobutyric acid is a non-proteinogenic alpha-amino acid that is isobutyric acid in which the alpha-hydrogen has been replaced by a methylamino group. It has a role as a human urinary metabolite. It is an alanine derivative, a secondary amino compound and a non-proteinogenic alpha-amino acid. It is functionally related to an isobutyric acid. It is a tautomer of a N-methyl-aminoisobutyrate zwitterion.

Namen und Bezeichner

Bevorzugter Name
alpha-(Methylamino)isobutyric acid
IUPAC
2-methyl-2-(methylamino)propanoic acid
Lokaler Name
2-(Methylamino)isobuttersaeure
Englischer Name
N-Me-Aib-OH HCl
Summenformel
C5H11NO2
Molmasse
117.15

Namen und Synonyme

2566-34-92-(Methylamino)isobutyric acidN,2-dimethylalaninealpha-(Methylamino)isobutyric acidN-(methylamino)isobutyric acidalpha-methylaminoisobutyratealpha-(methylamino)isobutyrate26F96C8MBJDTXSID90180360CHEBI:134261AMAIBN-methyl alpha-aminoisobutyric acid
Weitere Namen anzeigen
N-ME-AIB-OHH-MEAIB-OHH-N-Me-Aib-OHH-(ME)MEALA-OHN-Me-Aib-OH HClN-Me-a-Me-Ala-OH2,N-DIMETHYLALANINE
RefChem:461320DTXCID00102851219-898-22-methyl-2-(methylamino)propanoic acidMeAIBAlanine, N,2-dimethyl-N,2-Dimethyl-DL-alanineMFCD00004191

Datenbank-Bezeichner

CAS
2566-34-9
PubChem CID
75725
DTXSID
DTXSID90180360
ChEMBL
CHEMBL1916079
ChEBI
CHEBI:134261
UNII
26F96C8MBJ
EC Number
219-898-2
Nikkaji
J192.071E

Eigenschaften

Berechnete Struktureigenschaften

XLogP
-2,3
Polarare Oberfläche (TPSA)
49,3 Ų
H-Brücken-Donoren
2
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
2
Schwere Atome
8

Experimentelle und physikochemische Eigenschaften

Melting Point300 °C
Physical DescriptionSolid

Physikochemische Eigenschaften

Schmelzpunkt
300 °C · 300 °C
Siedepunkt
192.5 · 192.5±23.0 °C(Predicted)
Dichte
1.2 · 1.2000 (estimate)
Brechungsindex
1.465 · 1.4650 (estimate)
storage temp.
-20 °C · Keep in dark place,Sealed in dry,Store in freezer, under -20°C
Wasserlöslichkeit
almost transparency in Water

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 1 notifications to the ECHA C&L Inventory.

Gefahrenhinweise

Hazard Classes and CategoriesEye Irrit. 2 (100%)

Sicherheitsdaten

wgk
3
hs_code
2922.49.8000
risk_code
36
hazard_code
Xi
safety_code
26
Speicherklasse
11 - Combustible Solids

Chemie und Industrie

Anbieter67 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
江苏吉泰肽业科技有限公司051580855088 18762539991 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]

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