2-Methyl-1-(4-(methylthio)phenyl)-2-morpholino-1-propanone (HCID 92387)

개요

a photo-initiator

이름 및 식별자

우선 이름: 2-Methyl-1-(4-(methylthio)phenyl)-2-morpholino-1-propanone
IUPAC: 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one
현지명: 2-메틸-1-(4-(메틸티오)페닐)-2-(4-몰폴리닐)-1-프로파논
영어명: 2-Methyl-4'-(methylthio)-2-morpholinopropiophenone
분자식: C15H21NO2S
분자량: 279.4

이름 및 동의어

71868-10-52-Methyl-4'-(methylthio)-2-morpholinopropiophenoneCACCURE 907DTXSID8038857Irganox 907722CLJ6H6K1-Propanone, 2-methyl-1-[4-(methylthio)phenyl]-2-(4-morpholinyl)-2-Methyl-1-(4-methylthiophenyl)-2-morpholinopropan-1-oneDTXCID60188572-Methyl-1-[4-(methylthio)phenyl]-2-morpholino-1-propanone1-Propanone, 2-methyl-1-(4-(methylthio)phenyl)-2-(4-morpholinyl)-IR-907

이름 더 보기

2-메틸-1-(4-(메틸티오)페닐)-2-(4-몰폴리닐)-1-프로파논2-메틸-1-(4-(메틸티오)페닐)-2-(4-몰폴리닐)-1-프로파논(2-METHYL-1-(4-(METHYLT...907Irgacure 907MMMPOmnirad 907YF-PI 9072-methyl-1-(4-methylthio)2-methyl-1-[4-(methylthio)phenyl]-2-(4-morpholinyl)-1-Propanone

2-Methyl-1-(4-(methylthio)phenyl)-2-morpholino-1-propanoneMTMP cpdMTMPPRefChem:475438400-600-6615-621-82-Methyl-1-(4-(methylthio)phenyl)-2-morpholinopropan-1-one2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one

데이터베이스 식별자

CAS: 71868-10-5
PubChem CID: 92387
DTXSID: DTXSID8038857
ChEMBL: CHEMBL1411716
UNII: 722CLJ6H6K
EC Number: 400-600-6、615-621-8
Nikkaji: J73.113G

물성

구조 계산 물성

XLogP: 2.4
극성 표면적: 54.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 4
무거운 원자 수: 19
형식 전하: 0
복잡도: 305

실험 및 물리화학적 성질

Drugs · 2건

DEA NFLIS-Drug Category -> Synthetic Cathinones

Pharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds

LogP3.49

Endocrine DisruptorsPotential endocrine disrupting compound

Physical DescriptionDry Powder; Large Crystals; Liquid

Collision Cross Section166.7 Å² [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: ESI+; Dataset: TOXCAST; Source Identifier: DTXSID8038857]

물리화학적 성질

녹는점: 74 · 74-76 °C(lit.)
끓는 점: 210 °C/76mmHg · 210°C/76mmHg(lit.)
밀도: 1.15 · 1.15±0.1 g/cm3(Predicted)
증기압: 0 Pa · 0Pa at 25℃
인화점: 165 ℃ · 165℃
저장 조건: Keep in dark place,Sealed in dry,Room Temperature
용해도: 162 in · 162 in mg/100g standard fat at 20 ℃
물리적 상태: powder to crystal
산도 계수 (pKa): 4.77 · 4.77±0.10(Predicted)
색상: 흰색에서 거의 흰색
수용성: 17.9 mg/L · 17.9mg/L at 20℃
화장품 원료 기능: 결합제
InChI: 1S/C15H21NO2S/c1-15(2,16-8-10-18-11-9-16)14(17)12-4-6-13(19-3)7-5-12/h4-7H,8-11H2,1-3H3
InChIKey: LWRBVKNFOYUCNP-UHFFFAOYSA-N
SMILES: CSc1ccc(cc1)C(=O)C(C)(C)N2CCOCC2
LogP: 3.09 at · 3.09 at 25℃
EPA: 1 · 1-Propanone, 2-methyl-1-[4-(methylthio)phenyl]-2-(4-morpholinyl)- (71868-10-5)

화학적 성질

White powder

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H302: 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)

Danger

H302 (100%): 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)

유해성 정보

Regulatory Information · 6건

Chemical: 1-Propanone, 2-methyl-1-[4-(methylthio)phenyl]-2-(4-morpholinyl)-

Hazard Traits - Reproductive Toxicity

1-Propanone, 2-methyl-1-[4-(methylthio)phenyl]-2-(4-morpholinyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Propanone, 2-methyl-1-[4-(methylthio)phenyl]-2-(4-morpholinyl)- 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)

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 22-04-2014 https://echa.europa.eu/registration-dossier/-/registered-dossier/1574

Substance: 2-methyl-1-(4-methylthiophenyl)-2-morpholinopropan-1-one

Other Safety InformationEvaluation - 1-Propanone, 2-methyl-1-[4-(methylthio)phenyl]-2-(4-morpholinyl)-

Hazard Classes and Categories · 5건

Acute Tox. 4 (99.4%)

Acute Tox. 4 (100%)

Acute toxicity - category 4

Reproductive toxicity - Category 1B

Repr. 1B

안전 데이터

wgk: 2
tsca: TSCA listed
ridadr: UN 3077 9/PG 3
HS 번호: 29349990
risk_code: 22-51/53
hazard_code: Xn,N
safety_code: 22-61
포장분류: III
위험 등급: 9
기존화학 물질: KE-24440
Hazard Classifications: Acute Tox. 4 OralAquatic Chronic 2Repr. 1B
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

용도 및 제조

U.S. Production2023: 50,000 - <250,000 lb

Consumer UsesPhotosensitive agent

Industry UsesNot Known or Reasonably Ascertainable

General Manufacturing Information · 2건

Paint and Coating Manufacturing

1-Propanone, 2-methyl-1-[4-(methylthio)phenyl]-2-(4-morpholinyl)-: ACTIVE

응용 분야 · 2건

용도1. 포토 이니시 에이터 907는 아크릴 레이트와 같은 올리고머가없는 라디칼 중합을 시작하기 위해 사용되는 고효율의 반응성 광개시제이다. 2.Phototinitiator 907 은 착색 된 UV 경화 시스템에 사용하기에 특히 적합합니다. 3. 포토 이니시에이터 907은 PCB 용 에칭 레지스트로 사용될 수 있습니다. 4. 포토 이니시 에이터 907는 석판 인쇄 잉크, 실크 스크린 잉크, 플 렉소 잉크, 오프셋 잉크, 잉크젯 잉크, 솔더 마스크, 플라스틱 코팅, 복합 재료, 전자 제품, 오버 프린트 바니시의 광개시제로 사용할 수 있습니다. 접착제 등

용도Photoinitiator-907 is an efficient UV photoinitiator for initiating UV polymerization of unsaturated prepolymer systems.