2-(5-Methyl-2-phenyl-1,3-oxazol-4-yl)ethyl methanesulfonate

HCID 10540773

기본 정보

CAS
227029-27-8
표준 SMILES
Cc1oc(-c2ccccc2)nc1CCOS(C)(=O)=O
InChIKey
SIRKPSSXHXSLMR-UHFFFAOYSA-N
분자식
C13H15NO4S
평균 분자량
281.33 g/mol
단동위원소 질량
281.07217896

이름 및 식별자

우선 이름
2-(5-Methyl-2-phenyl-1,3-oxazol-4-yl)ethyl methanesulfonate
IUPAC
2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethyl methanesulfonate
영어명
2-(5-METHYL-2-PHENYL-1,3-OXAZOL-4-YL)ETHYL METHANESULFONATE
분자식
C13H15NO4S
분자량
281.33

이름 및 동의어

227029-27-82-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethyl methanesulfonateMethanesulfonic acid 2-(5-methyl-2-phenyloxazol-4-yl)ethyl ester4-Oxazoleethanol, 5-methyl-2-phenyl-, 4-methanesulfonate2-(5-METHYL-2-PHENYLOXAZOL-4-YL)ETHYL METHANESULFONATE2-(5-Methyl-2-phenyl-oxazol-4-yl)ethyl methanesulfonateSCHEMBL8214052-(5-methyl-2-phenyl-4-oxazolyl)ethyl methanesulfonateDTXSID30441528SIRKPSSXHXSLMR-UHFFFAOYSA-NCS-M2368MFCD17014833
이름 더 보기
MURA-0022-(5-Methyl-2-phenyl-oxazol-4-yl)ethyl mesylate
AKOS015917904CS-13627DB-291901Methanesulfonicacid2-(5-methyl-2-phenyloxazol-4-yl)ethylestermethanesulfonic acid 2-(5-methyl-2-phenyl-oxazol-4-yl)-ethyl estermethanesulfonic acid 2-(5-methyl-2-phenyloxazol-4-yl)-ethyl ester

데이터베이스 식별자

CAS
227029-27-8
PubChem CID
10540773
DTXSID
DTXSID30441528

물성

구조 계산 물성

XLogP
2.1
극성 표면적
77.8 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
5
회전 가능 결합 수
5
무거운 원자 수
19

물리화학적 성질

끓는 점
490.4 · 490.4±47.0 °C(Predicted)
밀도
1.257 · 1.257±0.06 g/cm3(Predicted)
산도 계수 (pKa)
0.96 · 0.96±0.26(Predicted)

화학 및 산업

공급사6 곳

梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
苏州美石生物科技有限公司1173954148q · [email protected]
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
AbaChemScene732-484-9848 · [email protected]
南京克罗托鲁宁医药科技有限公司13382066392

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