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N-(2-Bromoacetyl)-β-alanine

N-(2-Bromoacetyl)-β-alanine structure

CAS No:
89520-11-6
Formula:
C5H8BrNO3
Chemical Name:
N-(2-Bromoacetyl)-β-alanine
Synonyms:
β-Alanine,N-(2-bromoacetyl)-;β-Alanine,N-(bromoacetyl)-;N-(2-Bromoacetyl)-β-alanine;N-Bromoacetyl-β-alanine

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

Molecular Weight：

210.03

Exact Mass：

210.03

DSSTox ID：

DTXSID70571015

Characteristics

Density：

1.682±0.06 g/cm3

Melting Point：

71-77°C

Boiling Point：

433.4±30.0 °C(Predicted)

PKA：

4.27±0.10

Computed Properties

Molecular Weight:210.03
XLogP3:-0.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:208.96876
Monoisotopic Mass:208.96876
Topological Polar Surface Area:66.4
Heavy Atom Count:10
Complexity:137
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-(2-Bromoacetyl)-β-alanine

Basic Attributes
Characteristics
Computed Properties

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