Dibenzyl
기본 정보
- CAS
103-29-7- 표준 SMILES
c1ccc(CCc2ccccc2)cc1- InChIKey
QWUWMCYKGHVNAV-UHFFFAOYSA-N- 분자식
- C14H14
- 평균 분자량
- 182.26 g/mol
- 단동위원소 질량
- 182.10955045
개요
1,2-dihydrostilbene is a diphenylethane that is the 1,2-dihydro derivative of stilbene.
이름 및 식별자
- 우선 이름
- Dibenzyl
- IUPAC
- 2-phenylethylbenzene
- 영어명
- 1,2-Diphenylethane
- 분자식
- C14H14
- 분자량
- 182.26096
이름 및 동의어
1,2-DiphenylethaneBIBENZYL103-29-7Dibenzyl1,2-DihydrostilbeneDibenzilsym-Diphenylethane2-phenylethylbenzeneBenzene, 1,1'-(1,2-ethanediyl)bis-DTXSID8041668NSC-30686007C07V77Z
이름 더 보기
DTXCID6021668CHEBI:340471,1'-(1,2-ethanediyl)bis(benzene)RefChem:119638203-096-4(2-Phenylethyl)benzenes-DiphenylethaneDihydrostilbene
데이터베이스 식별자
- CAS
103-29-7- PubChem CID
- 7647
- DTXSID
DTXSID8041668- ChEMBL
CHEMBL440895- ChEBI
CHEBI:34047- UNII
- 007C07V77Z
- EC Number
- 203-096-4
- Nikkaji
- J5.013J
물성
구조 계산 물성
- XLogP
- 4.8
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 0
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 14
- 형식 전하
- 0
- 복잡도
- 120
실험 및 물리화학적 성질
Chemical ClassesOther Classes -> Aromatic Hydrocarbons
LipidsPolyketides [PK] -> Aromatic polyketides [PK13] -> Diphenyl ethers, biphenyls, dibenzyls and stilbenes [PK1309]
PolymersPolycyclic aromatic hydrocarbon
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
LogP4.6
Density1.00 @25 °C
Boiling Point284 °C @760 [mm Hg]
Melting Point52 °C
Physical Description
Liquid
Solid; [Merck Index] White crystals, insoluble in water; [MSDSonline]
물리화학적 성질
- 녹는점
- 52.5 °C · 52.5 °C
- 끓는 점
- 284 °C · 284°C
- 밀도
- 1 · 1
- 증기 밀도
- 6.29 · 6.29
- 인화점
- 264 °F · 264°F
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 46.2% (91 of 197) of reports.
H413 (53.8%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 197 reports by companies from 2 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: Benzene, 1,1'-(1,2-ethanediyl)bis-
Benzene, 1,1'-(1,2-ethanediyl)bis- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzene, 1,1'-(1,2-ethanediyl)bis- 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)
REACH registered substance: 1,2-diphenylethane (EC: 203-096-4)
Benzene, 1,1'-(1,2-ethanediyl)bis-: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryA skin, eye, and respiratory tract irritant; [MSDSonline]
Hazard Classes and CategoriesAquatic Chronic 4 (53.8%)
안전 및 보호
Protective Action Criteria (PAC)
14 [mg/m3]
150 [mg/m3]
890 [mg/m3]
안전 데이터
- 독성
- Poison by intravenous route.Moderately toxic by intraperitoneal route. Combustible.To fight fire, use water, spray, mist, alcohol foam, drychemical. When heated to decomposition it emits acridsmoke and fumes
화학 및 산업
용도 및 제조
UsesUsed as an intermediate in the biosynthesis of dihydrophenanthrenes from phenylalanine; [ChemIDplus]
U.S. Production2023: 10,000,000 - <25,000,000 lb
Consumer UsesFlame retardant
Industry UsesInsulators
General Manufacturing Information
Electrical Equipment, Appliance, and Component Manufacturing
Benzene, 1,1'-(1,2-ethanediyl)bis-: ACTIVE
관련 반응
17건
화합물 노트
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