Ethyl 3-isocyanatopropionate

ALDRICH/479012 - 98%

CAS Number: 5100-34-5
Empirical Formula (Hill Notation): C₆H₉NO₃
Molecular Weight: 143.14
MDL Number: MFCD00078461
Linear Formula: OCNCH₂CH₂CO₂C₂H₅
Product Type: Chemical

Catalog Number	PKG Qty.	Price	Quantity


45-479012-2G	2 g	$121.00 1/EA		Add To Favorites
45-479012-10G	10 g	$367.00 1/EA		Add To Favorites

Properties
Descriptions
Safety Info.
Basic Data

assay	98%
bp	68 °C/3 mmHg (lit.)
density	1.087 g/mL at 25 °C (lit.)
functional group	amine
	ester
	isocyanate
InChI	1S/C6H9NO3/c1-2-10-6(9)3-4-7-5-8/h2-4H2,1H3
InChI key	XBSGYVHOINMTIM-UHFFFAOYSA-N
Quality Level	100
refractive index	n20/D 1.429 (lit.)
SMILES string	CCOC(=O)CCN=C=O
storage temp.	2-8°C

Application:	Ethyl 3-isocyanatopropionate may be used in the synthesis of ethyl N-{[(3-[(tert-butoxycarbonyl)(-cholestan-3-yl)amino]propyl)amino]carbonyl}-β-alaninate.
General description:	Ethyl 3-isocyanatopropionate, also known as ethyl N-(oxomethylene)-β-alaninate, is an aliphatic isocyanate.
Packaging:	2, 10 g in glass bottle

Symbol	GHS07,GHS08
Signal word	Danger
Hazard statements	H302 + H312 + H332 - H315 - H317 - H319 - H334 - H335
Precautionary statements	P261 - P264 - P280 - P301 + P312 - P302 + P352 + P312 - P305 + P351 + P338
Hazard Codes	Xn
Risk Statements	20/21/22-36/37/38
Safety Statements	23-26-36
RIDADR	UN 2206PSN1B 6.1 / PGIII
WGK Germany	WGK 3
Flash Point(F)	199.4 °F - closed cup
Flash Point(C)	93 °C - closed cup

Purity	98%
bp	68 °C/3 mmHg (lit.)
Density	1.087 g/mL at 25 °C (lit.)
Refractive Index	n20/D 1.429 (lit.)
Storage Temp.	2-8°C
UNSPSC	12352100

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