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Methyl phenylglyoxylate

Methyl phenylglyoxylate structure

CAS No:
15206-55-0
Formula:
C9H8O3
Chemical Name:
Methyl phenylglyoxylate
Synonyms:
Benzeneacetic acid,α-oxo-,methyl ester;Glyoxylic acid,phenyl-,methyl ester;Phenylglyoxylic acid methyl ester;Methyl benzoylformate;Methyl oxophenylacetate;Methyl phenylglyoxylate;Methyl phenylglyoxalate;Methyl phenyloxoacetate;Vicure 55;Methyl α-oxobenzeneacetate;α-Oxobenzeneacetic acid methyl ester;Methyl 2-oxo-2-phenylacetate;NSC 171206;NSC 409881;Darocur MBF;Methyl phenyl-α-oxoacetate;Benzoylformic acid methyl ester;Darocur MB;2-Oxo-2-phenylacetic acid methyl ester;Methyl 2-phenyl-2-oxoacetate;Speedcure MBF;Genocure MBF;Methoxycarbonyl phenyl ketone;MBF;Irgacure MBF;JRCure 1055;IHT-PI MBF;Doublecure 200;PI 55;MBF 1055;SB-PI 716;Photoinitiator MBF;Gencure MBF;Omnirad MBF;Micure MBF;Chemcure 55;71833-42-6;301543-54-4
Categories:
Cosmetic Ingredient > Nail Conditioning

Description

CLEAR YELLOW LIQUIDChEBI: The methyl ester of phenylglyoxylic acid with methanol. Metabolite observed in cancer metabolism.

Liquid

Methyl phenylglyoxalate is the methyl ester of phenylglyoxylic acid with methanol. Metabolite observed in cancer metabolism. It has a role as a human metabolite. It is a methyl ester and an alpha-ketoester. It derives from a phenylglyoxylic acid.

Methyl phenylglyoxylate Basic Attributes

Molecular Weight：

164.16

Exact Mass：

164.16

EC Number：

239-263-3

UNII：

23F2045STG

NSC Number：

409881|171206

DSSTox ID：

DTXSID9065867

HScode：

29183000

Characteristics

PSA：

43.4

XLogP3：

1.7

Appearance：

Clear yellow Liquid

Density：

1.163 g/mL at 20 °C(lit.)

Melting Point：

16°C

Boiling Point：

254.6-255.6 °C @ Press: 756 Torr

Flash Point：

>230 °F

Refractive Index：

n 20/D 1.528

Storage Conditions：

Store below +30°C.

Vapor Pressure：

<0.1 hPa (20 °C)

Toxicity：

LD50 orally in Rabbit: > 5000 mg/kg LD50 dermal Rat > 5000 mg/kg

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

safety instructions：

24/25

Stability/Shelf Life：

Stable under normal temperatures and pressures.

GHS Classification：

|Warning|H315 (37.44%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 244 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Methyl phenylglyoxylate Use and Manufacturing

Methods of Manufacturing

The preparation method is to add sodium chloride and sulfuric acid into the reaction flask, stir at room temperature, add benzoyl nitrile dropwise, control the temperature at about 30 ℃, keep it for 3 hours after the dropwise addition, then add methanol dropwise, and reflux for 5 hours. After the reaction, the methanol is removed under reduced pressure to obtain the finished product.

Uses

UV-curable coatings and inks

Paint additives and coating additives not described by other categories

Paints and coatings

Manufacturing Info：

Adhesive manufacturing|Benzeneacetic acid, .alpha.-oxo-, methyl ester: ACTIVE

Computed Properties

Molecular Weight:164.16
XLogP3:1.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:164.047344113
Monoisotopic Mass:164.047344113
Topological Polar Surface Area:43.4
Heavy Atom Count:12
Complexity:180
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Methyl phenylglyoxylate

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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Methyl phenylglyoxylate

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