2-프로페닐페놀
2-Propenylphenol
기본 정보
- CAS
6380-21-8- 표준 SMILES
CC=Cc1ccccc1O- InChIKey
WHGXZPQWZJUGEP-UHFFFAOYSA-N- 분자식
- C9H10O
- 평균 분자량
- 134.17 g/mol
- 단동위원소 질량
- 134.07316494
이름 및 식별자
- 우선 이름
- 2-Propenylphenol
- IUPAC
- 2-prop-1-enylphenol
- 현지명
- 2-프로페닐페놀
- 영어명
- 2-Propenylphenol
- 분자식
- C9H10O
- 분자량
- 134.18
이름 및 동의어
2-Propenylphenol2-(1-Propenyl)phenolo-(Prop-1-enyl)phenolDTXSID70871163Phenol, opropenylPhenol, 2propenylo(Prop1enyl)phenol2(1Propenyl)phenolPhenol, 2(1propenyl)RefChem:483241DTXCID108188356380-21-8
이름 더 보기
2-프로페닐페놀(E)-2-(prop-1-en-1-yl)phenolBrn 2324090Einecs 228-961-3o-propenyl-pheno2-propenyl-phenoPhenol, o-propenyl-Phenol, 2-propenyl-2-(1-propenyl)-pheno
2-prop-1-enylphenolpropenylphenolPhenol, 2-(1-propenyl)-propenyl phenol138523-04-3SCHEMBL718133SCHEMBL1038004SCHEMBL1767263
데이터베이스 식별자
- CAS
6380-21-8- PubChem CID
- 93029
- DTXSID
DTXSID70871163- EC Number
- 228-961-3
물성
구조 계산 물성
- XLogP
- 2.6
- 극성 표면적
- 20.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 10
- 형식 전하
- 0
- 복잡도
- 118
실험 및 물리화학적 성질
Chemical ClassesOther Classes -> Phenols
Physical DescriptionColorless viscous liquid; [Sigma-Aldrich MSDS]
물리화학적 성질
- 녹는점
- -6 °C · -6°C
- 끓는 점
- 230 · 230-231 °C(lit.)
- 밀도
- 1.044 g/mL · 1.044 g/mL at 25 °C(lit.)
- 굴절률
- 20 · n20/D 1.578(lit.)
- 인화점
- 195 °F · 195 °F
- InChI
- InChI=1S/C9H10O/c1-2-5-8-6-3-4-7-9(8)10/h2-7,10H,1H3
- InChIKey
- WHGXZPQWZJUGEP-GORDUTHDSA-N
- SMILES
- C1(O)=CC=CC=C1C=CC
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory InformationPhenol, 2-(1-propenyl)-: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryAn irritant that may cause serious eye injury; [Sigma-Aldrich MSDS]
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
안전 데이터
- wgk
- 3
- rtecs
- SM8575000
- ridadr
- UN 3145 8/PG 3
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36/37/39
- 포장분류
- III
- 위험 등급
- 6.1(b)
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- 스토리지 클래스
- 10 - Combustible liquids
화학 및 산업
응용 분야
개요2-Propenylphenol, a mixture of cis and trans, is extensively employed in chemical research. 2-Propenylphenol, a Mixture Of Cis And Trans, is studied for its ability to polymerize and develop new polymeric materials with specific mechanical and chemical properties. It is utilized to investigate the effects of geometric isomerism on organic compounds' physical and chemical behaviour. The mixture′s role in synthesising advanced organic molecules, particularly those with potential applications in high-performance coatings and adhesives, is also a significant area of study.
일반 설명2-Propenylphenol on reaction with 2, 3-dichloro-5, 6-dicyanobenzoquinone yields spiropyran.
관련 반응
11건
화합물 노트
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