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N-(2-Carboxyethyl)-β-alanine

N-(2-Carboxyethyl)-β-alanine structure

CAS No:
505-47-5
Formula:
C6H11NO4
Chemical Name:
N-(2-Carboxyethyl)-β-alanine
Synonyms:
β-Alanine,N-(2-carboxyethyl)-;Propionic acid,3,3′-iminodi-;N-(2-Carboxyethyl)-β-alanine;Propanoic acid,3,3′-iminobis-;Bis(carboxyethyl)amine;3,3′-Iminodipropanoic acid;3,3′-Iminodipropionic acid;β,β′-Aminodipropionic acid;3,3′-Iminobis(propionic acid);NSC 41820

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N-(2-Carboxyethyl)-β-alanine Basic Attributes

Molecular Weight：

161.16

Exact Mass：

161.16

EC Number：

208-009-3

NSC Number：

41820

DSSTox ID：

DTXSID60198518

HScode：

2922499990

Characteristics

PSA：

86.63000

XLogP3：

-0.82

Density：

1.3±0.1 g/cm3

Melting Point：

235-236 °C (decomp)

Boiling Point：

394.2±27.0 °C at 760 mmHg

Flash Point：

192.2±23.7 °C

Refractive Index：

1.494

Storage Conditions：

0-10°C

Safety Information

Precautionary statement(s)：

P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362

Hazard Statements：

H315

Computed Properties

Molecular Weight:161.16
XLogP3:-3.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:161.06880783
Monoisotopic Mass:161.06880783
Topological Polar Surface Area:86.6
Heavy Atom Count:11
Complexity:130
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(2-Carboxyethyl)-β-alanine

Basic Attributes
Characteristics
Safety Information
Computed Properties

N-(2-Carboxyethyl)-β-alanine

SDS

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