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Methyl 2-ethylbutanoate

Methyl 2-ethylbutanoate structure

CAS No:
816-11-5
Formula:
C7H14O2
Chemical Name:
Methyl 2-ethylbutanoate
Synonyms:
Butanoic acid,2-ethyl-,methyl ester;Butyric acid,2-ethyl-,methyl ester;Butyric acid,α-ethyl-,ester with MeOH;Methyl 2-ethylbutyrate;Methyl 2-ethylbutanoate;2-Ethylbutanoic acid methyl ester;NSC 509555;2-Ethylbutyric acid methyl ester
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Methyl 2-ethylbutanoate Basic Attributes

Molecular Weight：

130.185

Exact Mass：

130.18

EC Number：

212-428-7

NSC Number：

509555

DSSTox ID：

DTXSID40231215

Characteristics

PSA：

26.30000

XLogP3：

2.12

Density：

0.8790 g/cm³ @ Temp: 20 °C

Melting Point：

-71°C (estimate)

Boiling Point：

137 °C

Flash Point：

33.4±8.3 °C

Refractive Index：

1.404

Computed Properties

Molecular Weight:130.18
XLogP3:1.9
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:130.099379685
Monoisotopic Mass:130.099379685
Topological Polar Surface Area:26.3
Heavy Atom Count:9
Complexity:84.9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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