8-Bromooct-1-ene

8-bromooct-1-ene · DK712 · bromo-8 octene-1 · 8-BROMO-1-OCTENE · 7-Octenyl Bromide · 1-Octene, 8-bromo- · 8-Bromo-1-octene 97% · 8-Bromooct-1-ene 98%

https://huagongshe.com/ko/chemical/75907

식별자 및 물리적 특성

CAS No.	2695-48-9
분자식	C8H15Br
평균 분자량	191.11 g/mol
단동위원소 질량	190.03571 g/mol
SMILES	C=CCCCCCCBr
InChIKey	SNMOMUYLFLGQQS-UHFFFAOYSA-N
PubChem CID	75907
EC No.	220-268-4
DTXSID	DTXSID30181437

화학 및 물리적 성질

XLogP	3.9
극성 표면적	0
수소 결합 공여자 수	0
수소 결합 수용자 수	0
회전 가능 결합 수	6
무거운 원자 수	9
형식 전하	0
복잡도	59
Kovats Retention Index	11211455
끓는 점	198-199°
밀도	1.139 g/mL at 25 °C (lit.)
굴절률	n20/D 1.467(lit.)
인화점	78°C
저장 조건	under inert gas (nitrogen or Argon) at 2–8 °C
용해도	클로로포름, 에틸아세테이트에 용해됨
물리적 상태	액체
색상	담황색
BRN	2234481
InChI	1S/C8H15Br/c1-2-3-4-5-6-7-8-9/h2H,1,3-8H2
InChIKey	SNMOMUYLFLGQQS-UHFFFAOYSA-N
SMILES	BrCCCCCCC=C
NIST	8-Bromo-1-octene(2695-48-9)

화학적 성질

Light yellow liquid

안전 및 규제

GHS 분류	WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (97.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract 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 43 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard Classes and Categories	Skin Irrit. 2 (100%)Eye Irrit. 2 (100%)STOT SE 3 (97.7%)
수질 위해 등급(WGK)	3
관세 코드	29033990
위험 문구(R)	36/37/38
위험 표시	Xi
안전 문구(S)	26-36
위험 등급	IRRITANTEye Irrit. 2Skin Irrit. 2STOT SE 3
저장 분류	10 - Combustible liquids

용도

8-Bromo-1-octene has been used in preparation of polymerizable ligand, required for the synthesis of quantum dot-labeled polymer beads. Grignard reagent derived from 8-bromo-1-octene has been used in the synthesis of (2S,3S,5R)-5-[(1R)-1-hydroxy-9-decenyl]-2-pentyltetrahydro-3-furanol. It has been used as building block in natural product synthesis. Also used for the synthesis of more complex pharmaceutical compounds, such as Dithienogermole (DTG) derivatives with varying alkyl chain lengths and pendant functionalities.