다이메틸 숙시노숙신

1,4-Cyclohexanedicarboxylic acid, 2,5-dioxo-, 1,4-dimethyl ester

HCID 94866CAS 6289-46-9
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
COC(=O)C1CC(=O)C(C(=O)OC)CC1=O
InChIKey
MHKKFFHWMKEBDW-UHFFFAOYSA-N
분자식
C10H12O6
평균 분자량
228.2 g/mol
단동위원소 질량
228.0633881

이름 및 식별자

우선 이름
1,4-Cyclohexanedicarboxylic acid, 2,5-dioxo-, 1,4-dimethyl ester
IUPAC
dimethyl 2,5-dioxocyclohexane-1,4-dicarboxylate
현지명
다이메틸 숙시노숙신
영어명
2,5-dioxo-1,4-cyclohexanedicarboxylic acid dimethyl ester
분자식
C10H12O6
분자량
228.2

이름 및 동의어

Dimethyl 2,5-dioxocyclohexane-1,4-dicarboxylateDimethyl succinylsuccinateSuccinosuccinic acid, dimethyl esterDTXSID3027617NSC 5670Dimethyl 2,5-dioxo-1,4-cyclohexanedicarboxylateEINECS 228-528-9NSC 122567AI3-14663DTXCID0076171,4-Cyclohexanedicarboxylic acid, 2,5-dioxo-, dimethyl esterEC 228-528-9
이름 더 보기
다이메틸숙시노숙신다이메틸숙시노숙신2,5-디옥소-1,4-시클로헥산디카르복실산디메틸에스테르DMSSdimethyl succinosuccinateDIMETHYL SUCCINYLOSUCCINATE2,5-dioxo-1,4-cyclohDimethyl succinate succinateDiMethyl succinylo succinate, 99+%Succinosuccinic acid dimethyl esterSuccinylsuccinic acid dimethyl ester
1,4-Cyclohexanedicarboxylic acid, 2,5-dioxo-, 1,4-dimethyl esterRefChem:416587228-528-9InChI=1/C10H12O6/c1-15-9(13)5-3-8(12)6(4-7(5)11)10(14)16-2/h11-12H,3-4H2,1-2H3XZBODPPGVQZFEG-UHFFFAOYSA-6289-46-9Dimethyl 1,4-cyclohexanedione-2,5-dicarboxylateMFCD00001607

데이터베이스 식별자

CAS
6289-46-9
PubChem CID
94866
DTXSID
DTXSID3027617
ChEMBL
CHEMBL3185753
EC Number
228-528-9
Nikkaji
J160.439B

물성

구조 계산 물성

XLogP
-0.4
극성 표면적
86.7 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
6
회전 가능 결합 수
4
무거운 원자 수
16

실험 및 물리화학적 성질

Physical DescriptionCBI

물리화학적 성질

녹는점
154 · 154-157 °C
끓는 점
330 °C · 330°C (rough estimate)
밀도
1.3792 · 1.3792 (rough estimate)
증기압
0 · 0-0.002Pa at 20-50℃
굴절률
1.6 · 1.6000 (estimate)
저장 조건
Inert atmosphere,Room Temperature

화학적 성질

white to light yellow-green fine cryst. powder

안전 및 규제

GHS 분류

GHS Classification · 3건

This chemical does not meet GHS hazard criteria for 94.6% (106 of 112) of all reports.

Not Classified

Aggregated GHS information provided per 112 reports by companies from 2 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory Information · 3건

Chemical: 1,4-Cyclohexanedicarboxylic acid, 2,5-dioxo-, dimethyl ester

1,4-Cyclohexanedicarboxylic acid, 2,5-dioxo-, 1,4-dimethyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,4-Cyclohexanedicarboxylic acid, 2,5-dioxo-, 1,4-dimethyl 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: 13-06-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/1907

Hazard Classes and CategoriesNot Classified

안전 데이터

wgk
1
tsca
TSCA listed
HS 번호
29145090
risk_code
36/37/38
hazard_code
Xi
safety_code
37/39-26-24/25

화학 및 산업

용도 및 제조

U.S. Production2023: <50,000 lb
Consumer UsesPigment
Industry UsesPigment
General Manufacturing Information · 2건

Synthetic Dye and Pigment Manufacturing

1,4-Cyclohexanedicarboxylic acid, 2,5-dioxo-, 1,4-dimethyl ester: ACTIVE

응용 분야 · 1건

용도Dimethyl 1,4-cyclohexanedione-2,5-dicarboxylate is used in the production of pigments such as pigment red 122 and pigment violet 19. It also can react with 2,4-diamino-phenol to get 2,5-bis-(3-amino-4-hydroxy-phenylamino)-cyclohexa-1,4-diene-1,4-dicarboxylic acid dimethyl ester.

상·하류 제품 정보

공급사50 곳

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]
郑州阿尔法化工有限公司+86-18530059196 · [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]

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