헥센(-5)-1-올
5-Hexen-1-ol
데이터를 보충하는 중입니다. 잠시 후 페이지를 새로 고치면 최신 내용을 볼 수 있습니다
기본 정보
- CAS
821-41-0- 표준 SMILES
C=CCCCCO- InChIKey
UIZVMOZAXAMASY-UHFFFAOYSA-N- 분자식
- C6H12O
- 평균 분자량
- 100.16 g/mol
- 단동위원소 질량
- 100.088815
개요
5-hexen-1-ol has been reported in Thymus vulgaris with data available.
이름 및 식별자
- 우선 이름
- 5-Hexen-1-ol
- IUPAC
- hex-5-en-1-ol
- 현지명
- 헥센(-5)-1-올
- 영어명
- 5-Hexen-1-ol
- 분자식
- C6H12O
- 분자량
- 100.16
이름 및 동의어
5-Hexen-1-olHex-5-en-1-ol1-Hexen-6-ol5-HexenolUNII-57PD1RF6G757PD1RF6G7EINECS 212-477-46-hydroxy-1-hexeneAI3-347975-HEXENOL [FHFI]1-HEXENE-6-OLDTXSID2074950
이름 더 보기
헥센(-5)-1-올5-헥센-1-올5-hexeen-1-ol5-Hexen-1-ol>5-Hexen-1-ol,99%5-HEXEN-1-OL 99%6-Hydroxyhex-1-ene5-Hexen-1-ol, 97+%
FEMA NO. 43515HexenolHex5en1olRefChem:102709DTXCID0048266InChI=1/C6H12O/c1-2-3-4-5-6-7/h2,7H,1,3-6HUIZVMOZAXAMASY-UHFFFAOYSA-N821-41-0
데이터베이스 식별자
- CAS
821-41-0- PubChem CID
- 69963
- DTXSID
DTXSID2074950- UNII
- 57PD1RF6G7
- EC Number
- 212-477-4
- Nikkaji
- J100.726B
물성
구조 계산 물성보충 중
- XLogP
- 1.4
- 극성 표면적
- 20.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 1
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 7
- 형식 전하
- 0
- 복잡도
- 41.4
실험 및 물리화학적 성질
PolymersOther Classes -> Alcohols and Polyols, Other
SpringerMaterials PropertiesOptical coefficient
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.845-0.849
Solubility
Soluble in water and most fixed oils
Soluble (in ethanol)
Boiling Point154-155 °C
Refractive Index1.434-1.437
Physical Description
Clear colorless liquid; [Sigma-Aldrich MSDS]
Colourless liquid; Green aroma
물리화학적 성질
- 녹는점
- -20 °C · <-20°C
- 끓는 점
- 157 °C · 157 °C
- 밀도
- 0.85 · 0.85
- 굴절률
- 1.44 · 1.44
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 26.3% (55 of 209) of reports.
Danger
H226 (36.4%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 209 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Status: Active Update: 30-11-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/23764
5-Hexen-1-ol: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryMay cause irritation; [Sigma-Aldrich MSDS] See 3-Buten-2-ol.
Hazard Classes and CategoriesFlam. Liq. 3 (36.4%)
안전 데이터
- wgk
- 1
- tsca
- TSCA listed
- ridadr
- UN 1987 3/PG 3
- HS 번호
- 2905290000
- risk_code
- 10
- hazard_code
- F
- safety_code
- 16-24/25
- 포장분류
- III
- 위험 등급
- 3
- 기존화학 물질
화학 및 산업
용도 및 제조
Use Classification
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
General Manufacturing Information5-Hexen-1-ol: ACTIVE
응용 분야
용도5-Hexen-1-ol is used in cyclization to a tetrahydropyran by phenylselenoetherification. It is also used as a building block in synthetic chemistry. Further, it is used to prepare 6-bromo-hex-1-ene by reaction with phosphorus tribromide.
제조 방법
5-hexen-1-ol may be prepared from 2-(chloromethyl)tetrahydropyran according to the literature procedure for the preparation of 4-penten-1-ol (Brooks, L. A.; Snyder, H. R. Org. Synth. Coll. Vol. III 1955, 698).
상·하류 제품 정보
상류 원료
관련 반응
47건
화합물 노트
불러오는 중…