N-Formylglycin

FOR-GLY-OH · N-For-Gly-OH · Formylglycin · N-FORMYLGLYCIN · FORMYL-GLYCINE · N-FORMYLGLYCINE · N-α-Formylglycine · N-Formylglycine>Glycine, N-formyl-

Identifikatoren & physikalische Daten

CAS No.	2491-15-8
Summenformel	C3H5NO3
Durchschnittliche Molmasse	103,08 g/mol
Monoisotopische Masse	103,02694302 g/mol
SMILES	O=CNCC(=O)O
InChIKey	UGJBHEZMOKVTIM-UHFFFAOYSA-N
PubChem CID	75606
ChEBI	CHEBI:21717
EC No.	219-649-8
DTXSID	DTXSID10179615
Lokaler Name	N-Formylglycin

XLogP	-0,9
Polarare Oberfläche (TPSA)	66,4
H-Brücken-Donoren	2
H-Brücken-Akzeptoren	3
Frei drehbare Bindungen	2
Schwere Atome	7
Formalladung	0
Komplexität	80,2
SpringerMaterials Properties	Density
Schmelzpunkt	149-151 °C
Siedepunkt	193.26°C (rough estimate)
Dichte	1.4873 (rough estimate)
Brechungsindex	1.4940 (estimate)
Lagerbedingungen	2-8°C
Löslichkeit	Methanol (Slightly), Water (Slightly)very faint turbidity
Aggregatzustand	Solid
pKa (Säurekonstante)	pK1:3.43 (25°C)
Farbe	White
BRN	1749108
Hauptanwendungen	peptide synthesis
InChI	1S/C3H5NO3/c5-2-4-1-3(6)7/h2H,1H2,(H,4,5)(H,6,7)
InChIKey	UGJBHEZMOKVTIM-UHFFFAOYSA-N
SMILES	OC(=O)CNC=O
CAS Datenbank	2491-15-8(CAS DataBase Reference)

GHS-Einstufung	WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard Classes and Categories	Skin Irrit. 2 (100%)
Wassergefährdungsklasse (WGK)	3
Zollcode	29241990
RTECS-Nr.	MC0547000
Toxizität	LD50 unreported in rat: > 3gm/kg
Sicherheitshinweise (S)	22-24/25
Lagerklasse	11 - Combustible Solids

N-Formylglycine is a simple dipeptide and a post-translationally generated residue with unique catalytic capabilities and biotechnology applications.