Methanesulfonylacetic acid methyl ester

HCID 2759918
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기본 정보

CAS
62020-09-1
표준 SMILES
COC(=O)CS(C)(=O)=O
InChIKey
RQKDASVRZONLNQ-UHFFFAOYSA-N
분자식
C4H8O4S
평균 분자량
152.17 g/mol
단동위원소 질량
152.01432974

이름 및 식별자

우선 이름
Methanesulfonylacetic acid methyl ester
IUPAC
methyl 2-methylsulfonylacetate
영어명
METHYL METHANESULFONYLACETATE
분자식
C4H8O4S
분자량
152.17

이름 및 동의어

Methanesulfonylacetic Acid Methyl EsterRefChem:811541805-598-4Methyl Methanesulfonylacetate62020-09-1methyl 2-(methylsulfonyl)acetatemethyl 2-methanesulfonylacetatemethyl 2-methylsulfonylacetateMFCD00051842methyl methylsulfonylacetateSCHEMBL19685302-(methylsulfonyl)-1-methoxyethanone
이름 더 보기
Methyl (methylsulfonyl)acetateMETHYL METHANESULPHONYLACETATEMethylMethanesulfonylacetate>Methyl methylsulfonylacetate, 98+%Methyl methanesulfonylacetate, 98+%Methyl methanesulphonylacetate, 98+%
Methylsulfonylacetic acid methyl esterM1332(Methanesulfonyl)acetic acid methyl esterFT-0628752Acetic acid, (methylsulfonyl)-, methyl esterMethyl (methanesulfonyl)acetateDTXSID10374961AC8028

데이터베이스 식별자

CAS
62020-09-1
PubChem CID
2759918
DTXSID
DTXSID10374961
EC Number
805-598-4
Nikkaji
J2.639.324H

물성

구조 계산 물성

XLogP
-0.5
극성 표면적
68.8 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
3
무거운 원자 수
9

물리화학적 성질

녹는점
62 °C · 62 °C
끓는 점
296.3 · 296.3±23.0 °C(Predicted)
밀도
1.277 · 1.277±0.06 g/cm3(Predicted)
저장 조건
2 · 2-8°C
물리적 상태
powder to crystal
색상
White to Orange to Green

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.

Warning

H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]

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

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (50%)

안전 데이터

HS 번호
2915.90.1800
safety_code
22-24/25

화학 및 산업

응용 분야

용도Methyl methylsulfonylacetate is used as an active pharmaceutical ingredient.

상·하류 제품 정보

공급사75 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]

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