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1,3-Dimethyl 2-[4-(methoxycarbonyl)-2-nitrophenyl]propanedioate

1,3-Dimethyl 2-[4-(methoxycarbonyl)-2-nitrophenyl]propanedioate structure

CAS No:
1160293-27-5
Formula:
C13H13NO8
Chemical Name:
1,3-Dimethyl 2-[4-(methoxycarbonyl)-2-nitrophenyl]propanedioate
Synonyms:
Propanedioic acid,2-[4-(methoxycarbonyl)-2-nitrophenyl]-,1,3-dimethyl ester;1,3-Dimethyl 2-[4-(methoxycarbonyl)-2-nitrophenyl]propanedioate

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1,3-Dimethyl 2-[4-(methoxycarbonyl)-2-nitrophenyl]propanedioate Basic Attributes

Molecular Weight：

311.24422

Exact Mass：

311.24

DSSTox ID：

DTXSID60729200

HScode：

2918990090

Characteristics

PSA：

125

XLogP3：

1.33420

Density：

1.357±0.06 g/cm3(Predicted)

Boiling Point：

433.1±40.0 °C(Predicted)

Water Solubility：

H2O: Very slightly soluble (0.28 g/L) (25 ºC)

Computed Properties

Molecular Weight:311.24
XLogP3:1.5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:311.06411637
Monoisotopic Mass:311.06411637
Topological Polar Surface Area:125
Heavy Atom Count:22
Complexity:441
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,3-Dimethyl 2-[4-(methoxycarbonyl)-2-nitrophenyl]propanedioate

Basic Attributes
Characteristics
Computed Properties
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1,3-Dimethyl 2-[4-(methoxycarbonyl)-2-nitrophenyl]propanedioate

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