2-아이소프로필티오크산톤

2-Isopropylthioxanthone

HCID 79633CAS 5495-84-1
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CC(C)c1ccc2sc3ccccc3c(=O)c2c1
InChIKey
KTALPKYXQZGAEG-UHFFFAOYSA-N
분자식
C16H14OS
평균 분자량
254.3 g/mol
단동위원소 질량
254.07653607

개요

structure in first source

이름 및 식별자

우선 이름
2-Isopropylthioxanthone
IUPAC
2-propan-2-ylthioxanthen-9-one
현지명
2-아이소프로필티오크산톤
영어명
2-Isopropylthioxanthone
분자식
C16H14OS
분자량
254.35

이름 및 동의어

2-Isopropylthioxanthone5495-84-12-Isopropyl-9H-thioxanthen-9-one2-(propan-2-yl)-9H-thioxanthen-9-one9H-Thioxanthen-9-one, 2-(1-methylethyl)-Isopropyl thioxanthoneDTXSID104469154KUS6SE2TPL-ITXDTXCID9024691RefChem:473931226-827-9
이름 더 보기
2-아이소프로필티오크산톤2-아이소프로필티오크산톤(2-ISOPROPYLTHIOXANTHONE)아이소프로필티오잔톤ITXOMNIRAD ITXPhotoinitiator ITX2-IsopropylthioxanthonISOPROPYLTHIOXANTHONE2-isopropyithioxanthonePhotocure-Itx2-isopropylthioxantone
2-Isopropyl Thioxanthone2-Isopropyltioxanthone2-propan-2-ylthioxanthen-9-one2-Isopropylthioxanthen-9-one54958-41-7MFCD00055658Quantacure itxSpeedcure ITX

데이터베이스 식별자

CAS
5495-84-1
PubChem CID
79633
DTXSID
DTXSID1044691
ChEMBL
CHEMBL3184930
UNII
54KUS6SE2T
EC Number
226-827-9
Nikkaji
J210.557H

물성

구조 계산 물성

XLogP
5.1
극성 표면적
42.4 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
1
무거운 원자 수
18

실험 및 물리화학적 성질

Endocrine DisruptorsPotential endocrine disrupting compound
Physical DescriptionLarge Crystals; CBI
Collision Cross Section155.5 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID1044691]

물리화학적 성질

녹는점
76 °C · 76 °C
끓는 점
398.9 · 398.9±32.0 °C(Predicted)
밀도
1.199 · 1.199±0.06 g/cm3(Predicted)
증기압
0 Pa · 0Pa at 20℃
인화점
210 °C · 210 °C
저장 조건
Keep in dark place,Sealed in dry,Room Temperature

화학적 성질

2-Isopropylthioxanthone is light yellow solid with general solubility, effective at low concentration. The absorption wavelength is 250~400nm.

안전 및 규제

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 57.4% (189 of 329) of all reports.

Warning

H302 (17%): Harmful if swallowed [Warning Acute toxicity, oral]

P203, P264, P270, P273, P280, P301+P317, P318, P330, P391, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 329 reports by companies from 14 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 5건

Chemical: 9H-Thioxanthen-9-one, 2-(1-methylethyl)-

Regulation (EC) No 1935/2004 (amended)

9H-Thioxanthen-9-one, 2-(1-methylethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 9H-Thioxanthen-9-one, 2-(1-methylethyl)- 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: 18-01-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/24945

2-isopropyl-9H-thioxanthen-9-one: 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 CategoriesAcute Tox. 4 (17%)

안전 데이터

wgk
3
tsca
TSCA listed
HS 번호
29349990
risk_code
22
hazard_code
Xn
safety_code
20/21-58

화학 및 산업

용도 및 제조

U.S. Production2023: 75,000 - <500,000 lb
Consumer UsesPigment
Industry UsesNot Known or Reasonably Ascertainable
General Manufacturing Information · 2건

Synthetic Dye and Pigment Manufacturing

9H-Thioxanthen-9-one, 2-(1-methylethyl)-: ACTIVE

응용 분야 · 3건

개요2-Isopropylthioxanthone (ITX) has been widely used in many processes, such as printing inks, surface coatings, microelectronics, and photoresists. Nevertheless, it was also widely used in UV curing to promote the polymerization of inks used in paper- or plastic-based packaging materials because of its high photoinitiation efficiency and absorption characteristics at near-UV range (370385 nm).

용도2-Isopropylthioxanthone is a thioxanthone derivative useful as photoinitiators.

일반 설명2-Isopropylthioxanthone is a compound, which can play the role of a sulfur type photoinitiator in printing industries and UV-cured inks for food packaging materials.

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]
Syntechem Co.,Ltd[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
天津中信凯泰化工有限公司022-66880623 · [email protected]

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