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METHYL2,4-DIOXO-4-PHENYLBUTANOATE

METHYL2,4-DIOXO-4-PHENYLBUTANOATE structure

CAS No:
20577-73-5
Formula:
C11H10O4
Chemical Name:
METHYL2,4-DIOXO-4-PHENYLBUTANOATE
Synonyms:
METHYL 2,4-DIOXO-4-PHENYLBUTANOATE;alpha,gamma-Dioxobenzenebutanoic acid methyl ester;Methyl 2,4-dioxo-4-phenylbutyrate;Methyl 4-phenyl-2,4-dioxobutanoate;Methyl benzoylpyruvate;NSC 208703;2,4-diketo-4-phenyl-butyric acid methyl ester;2,4-dioxo-4-phenylbutanoic acid methyl ester
Categories:
Chemical Reagents > Organic Reagents

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METHYL2,4-DIOXO-4-PHENYLBUTANOATE Basic Attributes

Molecular Weight：

206.19

Exact Mass：

206.05790880 g/mol

NSC Number：

208703

DSSTox ID：

DTXSID60308731

HScode：

2918300090

Characteristics

PSA：

60.44000

XLogP3：

1.00150

Density：

1.205±0.06 g/cm3

Melting Point：

59-60°C

Boiling Point：

335.6±25.0 °C(Predicted)

Flash Point：

149ºC

Refractive Index：

1.56

Vapor Pressure：

2.89E-05mmHg at 25°C

PKA：

5.95±0.23

Safety Information

Hazard category：

IRRITANT

GHS Classification：

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:206.19
XLogP3:1.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:206.05790880
Monoisotopic Mass:206.05790880
Topological Polar Surface Area:60.4
Heavy Atom Count:15
Complexity:264
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of METHYL2,4-DIOXO-4-PHENYLBUTANOATE

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20577-73-5 methyl 2,4-dioxo-4-phenylbutanoate

CAS No.: 20577-73-5

Grade: Industrial Grade

Content: 95%

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Guide of METHYL2,4-DIOXO-4-PHENYLBUTANOATE

Basic Attributes
Characteristics
Safety Information
Computed Properties
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