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Ethyl-5-bromopyrimidine-2-carboxylate

Ethyl-5-bromopyrimidine-2-carboxylate structure

CAS No:
1197193-30-8
Formula:
C7H7BrN2O2
Chemical Name:
Ethyl-5-bromopyrimidine-2-carboxylate
Synonyms:
Ethyl-5-bromopyrimidine-2-carboxylate;5-broMo-4-ethylpyriMidine-2-carboxylate;Ethyl 5-broMopriMidine-2-carboxylate;5-bromo-2-Pyrimidinecarboxylic acid ethyl ester;2-Pyrimidinecarboxylic acid, 5-bromo-, ethyl ester
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Ethyl-5-bromopyrimidine-2-carboxylate Basic Attributes

Molecular Weight：

231.04668

Exact Mass：

229.969086

DSSTox ID：

DTXSID70680898

HScode：

2933599090

Characteristics

PSA：

52.1

XLogP3：

0.4

Appearance：

Off-white Crystalline

Density：

1.577±0.06 g/cm3(Predicted)

Boiling Point：

322.3±34.0 °C(Predicted)

Flash Point：

148.7±25.7 °C

Refractive Index：

1.548

Safety Information

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:231.05
XLogP3:0.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:229.96909
Monoisotopic Mass:229.96909
Topological Polar Surface Area:52.1
Heavy Atom Count:12
Complexity:158
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 1197193-30-8

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Guide of Ethyl-5-bromopyrimidine-2-carboxylate

Basic Attributes
Characteristics
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Computed Properties
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Ethyl-5-bromopyrimidine-2-carboxylate

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