5-Bromovaleryl chloride (HCID 521173)

이름 및 식별자

우선 이름: 5-Bromovaleryl chloride
IUPAC: 5-bromopentanoyl chloride
영어명: 5-Bromovaleryl chloride
분자식: C5H8BrClO
분자량: 199.47

이름 및 동의어

5-Bromovaleryl chloride4509-90-4DTXSID40334573RefChem:1072748DTXCID502856635-Bromopentanoyl chloride5-Bromovaleroyl Chloride5-Bromovalerylchloride5-bromovaleric acid chloride5-bromo-pentanoyl chloridebromovalerylchlorideMFCD00013660

이름 더 보기

TECO-0045-broMo-aMyl chloride5-BroMobalery chloride5-BromovalericChloride5-Bromovalery chloride5-BromovaIeryI Chloride5-Bromovaleryl chloride,98%

5-bromovaleric chlorideSCHEMBL50102AKOS006222732B2059H11319bromovaleryl cbromovaleryl chlorideAM85775

데이터베이스 식별자

CAS: 4509-90-4
PubChem CID: 521173
DTXSID: DTXSID40334573
UNII: X9K7ZM48B5
EC Number: 629-364-4
Nikkaji: J1.228.757G

물성

구조 계산 물성

XLogP: 2.2
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 4
무거운 원자 수: 8
형식 전하: 0
복잡도: 74.8

물리화학적 성질

끓는 점: 116 · 116-118 °C/33 mmHg (lit.)
밀도: 1.49 g/mL · 1.49 g/mL at 25 °C (lit.)
굴절률: 20 · n20/D 1.492(lit.)
인화점: 225 °F · 225 °F
저장 조건: -20 °C, · -20°C, sealed storage, away from moisture
물리적 상태: 투명한 액체
색상: Colorless to Light yellow to Light orange
Specific Gravity: 1.49 · 1.49
수용성: 물과 반응합니다.
InChI: InChI=1S/C5H8BrClO/c6-4-2-1-3-5(7)8/h1-4H2
InChIKey: OKRUMSWHDWKGHA-UHFFFAOYSA-N
SMILES: C(Cl)(=O)CCCCBr

화학적 성질

clear colorless to slightly yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P337+P317, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 54 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationStatus: Active Update: 07-12-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/28160

Hazard Classes and CategoriesSkin Corr. 1B (100%)

안전 데이터

wgk: 3
ridadr: UN 3265 8/PG 2
HS 번호: 29159000
risk_code: 34-36/37
hazard_code: C
safety_code: 26-27-28-36/37/39-45
포장분류: II
위험 등급: 8
위험 참고 사항: Harmful/Corrosive/Lachrymatory/Moisture Sensitive
Hazard Classifications: Eye Irrit. 2Skin Corr. 1BSTOT SE 3
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

응용 분야 · 2건

개요5-Bromovaleryl chloride is a chemical compound that functions as an acylating agent in organic synthesis. It is used to introduce the 5-bromovaleryl group into various organic molecules, allowing for the modification of their chemical properties. The mode of action of 5-Bromovaleryl chloride involves the substitution of the hydroxyl group in organic compounds with the 5-bromovaleryl group, leading to the formation of new chemical bonds. This process can be utilized to create novel compounds with specific functional groups for further study and analysis.

용도5-Bromovaleryl chloride was used in the preparation of aromatic azides and organic gelators.