Methyl phenylglyoxalate

HCID 84835CAS 15206-55-0

基本情報

標準SMILES
COC(=O)C(=O)c1ccccc1
InChIKey
YLHXLHGIAMFFBU-UHFFFAOYSA-N
分子式
C9H8O3
平均分子量
164.16 g/mol
単同位体質量
164.04734411

名称と識別子

優先名称
Methyl phenylglyoxalate
IUPAC
methyl 2-oxo-2-phenylacetate
英語名
methyl 2-oxo-2-phenyl-acetate
分子式
C9H8O3
分子量
0

名称と別名

Methyl benzoylformate15206-55-0methyl 2-oxo-2-phenylacetateMethyl phenylglyoxalateMethyl oxophenylacetateMethyl phenylglyoxylateBenzoylformic acid methyl esterPhenylglyoxylic acid methyl esterPhenylglyoxylic acid, methyl esterBenzeneacetic acid, .alpha.-oxo-, methyl estermethyl oxo(phenyl)acetateGlyoxylic acid, phenyl-, methyl ester
名称をさらに表示
NSC 171206alpha-oxobenzeneacetic acid methyl ester23F2045STGBenzeneacetic acid, alpha-oxo-, methyl esterEINECS 239-263-3NSC-171206NSC-4098812-Oxo-2-phenylacetic acid methyl ester

データベース識別子

CAS
15206-55-0、81065-82-9
PubChem CID
84835
DTXSID
DTXSID9065867
ChEBI
CHEBI:84256
UNII
23F2045STG
EC Number
239-263-3
Nikkaji
J60.885H

物性

構造計算による物性

XLogP
1.7
極性表面積
43.4 Ų
水素結合供与体数
0
水素結合受容体数
3
回転可能結合数
3
重原子数
12

実験および物理化学的性質

Physical DescriptionLarge Crystals; Liquid
Kovats Retention Index1335.1

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 17.1% (48 of 280) of reports.

Warning

H315 (26.4%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (56.1%): May cause an allergic skin reaction [Warning Sensitization, Skin];H319 (26.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H335 (26.4%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 280 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 48 of 280 reports by companies.;There are 6 notifications provided by 232 of 280 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Regulatory Information · 4 件

Chemical: Benzeneacetic acid, .alpha.-oxo-, methyl ester

Benzeneacetic acid, .alpha.-oxo-, methyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzeneacetic acid, .alpha.-oxo-, methyl ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 19-09-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/16435;Status: Cease Manufacture Update: 18-04-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/6562

Benzeneacetic acid, .alpha.-oxo-, methyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesSkin Irrit. 2 (26.4%);Skin Sens. 1 (56.1%);Eye Irrit. 2A (26.8%);STOT SE 3 (26.4%)

法規制情報

Regulatory Information · 4 件

Chemical: Benzeneacetic acid, .alpha.-oxo-, methyl ester

Benzeneacetic acid, .alpha.-oxo-, methyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzeneacetic acid, .alpha.-oxo-, methyl ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 19-09-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/16435;Status: Cease Manufacture Update: 18-04-2013 https://echa.europa.eu/registration-dossier/-/registered-dossier/6562

Benzeneacetic acid, .alpha.-oxo-, methyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

化学と産業

用途と製造

U.S. Production2023: 100,000 - <250,000 lb;2022: 50,000 - <75,000 lb;2021: 100,000 - <250,000 lb;2020: 25,000 - <50,000 lb
Consumer UsesPhotosensitive agent;Not Known or Reasonably Ascertainable
Industry UsesTanning agents not otherwise specified;Photosensitive agent;Not Known or Reasonably Ascertainable
General Manufacturing Information · 2 件

Adhesive Manufacturing;Not Known or Reasonably Ascertainable;Plastics Material and Resin Manufacturing;Paint and Coating Manufacturing;Printing Ink Manufacturing

Benzeneacetic acid, .alpha.-oxo-, methyl ester: ACTIVE

サプライヤー50 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
北京安司莫森技术有限公司010-82954736 13391601435 · [email protected]

関連反応

44 件

関連ノート

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