2-Fluoroethyl p-Toluenesulfonate

2-FLUOROETHYL TOSYLATE · Fluoroethylp-tosylate · 2-Fluoroethanol tosylate · L-TRYPTOPHAN/D-TRYPTOPHAN · 2-Fluoroethyl 4-methylben · FLUOROETHYL 4-TOLUENESULFONATE · Fluoroethyl p-toluenesulfonate · 2-Fluoro-ethanol 1-( tosylate)

https://huagongshe.com/ko/chemical/256019

식별자 및 물리적 특성

CAS No.	383-50-6
분자식	C9H11FO3S
평균 분자량	218.25 g/mol
단동위원소 질량	218.04129343 g/mol
SMILES	Cc1ccc(S(=O)(=O)OCCF)cc1
InChIKey	XNRDLSNSMTUXBV-UHFFFAOYSA-N
PubChem CID	256019
EC No.	834-543-7
DTXSID	DTXSID80292385

화학 및 물리적 성질

XLogP	1.8
극성 표면적	51.8
수소 결합 공여자 수	0
수소 결합 수용자 수	4
회전 가능 결합 수	4
무거운 원자 수	14
형식 전하	0
복잡도	250
끓는 점	140°C/1mmHg(lit.)
밀도	1.290 g/cm3
굴절률	1.5060 to 1.5100
저장 조건	under inert gas (nitrogen or Argon) at 2-8°C
용해도	클로로포름(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태	기름
색상	무색투명~엷은 갈색
InChI	InChI=1S/C9H11FO3S/c1-8-2-4-9(5-3-8)14(11,12)13-7-6-10/h2-5H,6-7H2,1H3
InChIKey	XNRDLSNSMTUXBV-UHFFFAOYSA-N
SMILES	C(OS(C1=CC=C(C)C=C1)(=O)=O)CF

안전 및 규제

GHS 분류	WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard Classes and Categories	Skin Irrit. 2 (100%)
관세 코드	2930909899

용도

2-Fluoroethyl Tosylate is an intermediate used in the preparation and pre-clinical evaluation of new class of high-affinity 18F-labeled PSMA ligands for detection of prostate cancer by positron emission tomography (PET) imaging.