기본 정보
- CAS
58465-67-1- 표준 SMILES
Cc1ccc(C(C)c2ccccc2)cc1C- InChIKey
FLWSNJAEMMOZJG-UHFFFAOYSA-N- 분자식
- C16H18
- 평균 분자량
- 210.31 g/mol
- 단동위원소 질량
- 210.14085058
개요
isolated from thorny skate, Raja radiata
이름 및 식별자
- 우선 이름
- Benzene, 1,2-dimethyl-4-(1-phenylethyl)-
- IUPAC
- 1,2-dimethyl-4-(1-phenylethyl)benzene
- 현지명
- 1-페닐-1-크실릴에탄
- 영어명
- 1,2-Dimethyl-4-(1-phenyl-ethyl)-benzene
- 분자식
- C16H18
- 분자량
- 210.31
이름 및 동의어
6196-95-8Benzene, 1,2-dimethyl-4-(1-phenylethyl)-1-(3,4-Dimethylphenyl)-1-phenylethane1-PHENYL-1-(3,4-DIMETHYLPHENYL)ETHANE1-phenyl-1-(3,4-xylyl)ethanePDEPEPhenyl-1-(3,4-dimethyl)phenylethaneI150P0702MDTXSID8027616RefChem:861645DTXCID607616228-249-2
이름 더 보기
1-페닐-1-크실릴에탄자일릴페닐에탄1-PHENYL-1-XYLYLETHANEPhenylxylylethane: (PXE)ScintiSafe? 30% Cocktail4-(α-Methylbenzyl)-o-xylenePhenyl-o-xylylethane (POXE)1-Phenyl-1-(3,4-xylyl)-ethane1-(1-Phenylethyl)-3,4-dimethylbenzene
1,2-dimethyl-4-(1-phenylethyl)benzene4-(1-Phenylethyl)-o-xyleneEthane, 1-phenyl-1-(3,4-xylyl)-Phenyl xylyl ethane58465-67-1UNII-I150P0702MEINECS 228-249-2PHENYL-O-XYLYL ETHANE
데이터베이스 식별자
- CAS
58465-67-1、6196-95-8- PubChem CID
- 22570
- DTXSID
DTXSID8027616
물성
구조 계산 물성
- XLogP
- 4.9
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 0
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 16
- 형식 전하
- 0
- 복잡도
- 202
실험 및 물리화학적 성질
Chemical ClassesOther Classes -> Aromatic Hydrocarbons
Vapor Pressure0.001 [mmHg]
Physical DescriptionClear colorless liquid with an aromatic odor; [Dixie Chemical MSDS]
물리화학적 성질
- 녹는점
- -56 °C · -56 °C
- 끓는 점
- 148 °C · 148 °C(Press: 5 Torr)
- 밀도
- 0.982 g/cm3 · 0.982 g/cm3
- 물리적 상태
- 액체
- 색상
- 무색의
- 화장품 원료 기능
- 용제
- EPA
- 4 · 4-(1-Phenylethyl)-o-xylene (6196-95-8)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H304 (10.3%): May be fatal if swallowed and enters airways [Danger Aspiration hazard]
P264, P273, P280, P301+P316, P302+P352, P321, P331, P332+P317, P362+P364, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: Benzene, 1,2-dimethyl-4-(1-phenylethyl)-
Benzene, 1,2-dimethyl-4-(1-phenylethyl)-: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryMay cause irritation; Inhalation may cause CNS depression; An aspiration hazard by ingestion (may cause lung injury); [Dixie Chemical MSDS] See Monobenzyl toluene.
Hazard Classes and CategoriesAsp. Tox. 1 (10.3%)
독성 정보
Adverse EffectsNeurotoxin - Acute solvent syndrome
안전 데이터
- tsca
- TSCA listed
- 기존화학 물질
- KE-11779
화학 및 산업
용도 및 제조
UsesIsolated from thorny skate, Raja radiata. [ChemIDplus]
General Manufacturing InformationBenzene, 1,2-dimethyl-4-(1-phenylethyl)-: ACTIVE
공급사8 곳
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
上海嵩爰化工科技有限公司010-1234567 18521000990 · [email protected]
西安乐纯化工有限责任公司029-15596886083 15596886083 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
湖北拓邦化工有限公司027-59106185 13986192185 · [email protected]
南通路特金进出口有限公司13951333918 · [email protected]
河南科弘生物科技有限公司0371-55969461 18638736641 · [email protected]
Nantong Root King lmport&Export Co.,Ltd+8615725632777 · [email protected]
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