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ethyl 2-[6-(4-nitrophenoxy)pyrimidin-4-yl]sulfanylacetate

ethyl 2-[6-(4-nitrophenoxy)pyrimidin-4-yl]sulfanylacetate structure

CAS No:
124066-45-1
Formula:
C14H13N3O5S
Chemical Name:
ethyl 2-[6-(4-nitrophenoxy)pyrimidin-4-yl]sulfanylacetate
Synonyms:
Acetic acid,((6-(4-nitrophenoxy)-4-pyrimidinyl)thio)-,ethyl ester; Acetic acid,2-[[6-(4-nitrophenoxy)-4-pyrimidinyl]thio]-,ethyl ester; ethyl <6-(4-nitrophenoxy)-4-pyrimidinylthio>acetate;

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ethyl 2-[6-(4-nitrophenoxy)pyrimidin-4-yl]sulfanylacetate Basic Attributes

Molecular Weight：

335.33500

Exact Mass：

335.05759170

DSSTox ID：

DTXSID90154208

Characteristics

PSA：

132.43000

XLogP3：

3.35550

Density：

1.42g/cm3

Boiling Point：

475.4ºC at 760mmHg

Flash Point：

241.3ºC

Refractive Index：

1.623

Vapor Pressure：

3.34E-09mmHg at 25°C

Computed Properties

Molecular Weight:335.34
XLogP3:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:335.05759170
Monoisotopic Mass:335.05759170
Topological Polar Surface Area:132
Heavy Atom Count:23
Complexity:398
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 2-[6-(4-nitrophenoxy)pyrimidin-4-yl]sulfanylacetate

Basic Attributes
Characteristics
Computed Properties
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