Octanedioyl dichloride

HCID 534653CAS 10027-07-3

기본 정보

표준 SMILES: O=C(Cl)CCCCCCC(=O)Cl
InChIKey: PUIBKAHUQOOLSW-UHFFFAOYSA-N
분자식: C8H12Cl2O2
평균 분자량: 211.08 g/mol
단동위원소 질량: 210.02143498

이름 및 식별자

우선 이름: Octanedioyl dichloride
IUPAC: octanedioyl dichloride
영어명: SUBEROYL CHLORIDE
분자식: C8H12Cl2O2
분자량: 211.09

이름 및 동의어

Suberoyl chlorideOctanedioyl dichloride10027-07-3DTXSID10143078RefChem:855956DTXCID0065569628-169-1suberoylchlorideSuberyl chlorideSuberic acid dichlorideSuberoyl dichlorideMFCD00000764

이름 더 보기

SUBERONYL CHLORIDESuberoylChloride>OCTANEDIOYL CHLORIDESuberoyl chloride,97%Suberoyl chloride 97%octanedioyldichloride

Suberyl dichlorideTG5X3247ULC8H12Cl2O2octanedioyl chlorideSUBERIC CHLORIDEOctanedioyl dichloride #SUBARIC DICHLORIDESUBERIC DICHLORIDE

데이터베이스 식별자

CAS: 10027-07-3
PubChem CID: 534653
DTXSID: DTXSID10143078
UNII: TG5X3247UL
EC Number: 628-169-1
Nikkaji: J208.953J

물성

구조 계산 물성

XLogP: 3
극성 표면적: 34.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 7
무거운 원자 수: 12
형식 전하: 0
복잡도: 139

실험 및 물리화학적 성질

SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy

물리화학적 성질

녹는점: 61 · 61-62 °C
끓는 점: 162 · 162-163 °C15 mm Hg(lit.)
밀도: 1.172 g/mL · 1.172 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.468(lit.)
인화점: 230 °F · >230 °F
저장 조건: 2 · 2-8°C
물리적 상태: 투명한 액체
색상: Colorless to Light orange to Yellow
수용성: 물과 반응합니다.
InChI: 1S/C8H12Cl2O2/c9-7(11)5-3-1-2-4-6-8(10)12/h1-6H2
InChIKey: PUIBKAHUQOOLSW-UHFFFAOYSA-N
SMILES: ClC(=O)CCCCCCC(Cl)=O

화학적 성질

clear colorless to brown liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

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

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

Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

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

안전 데이터

wgk: 3
ridadr: UN 3265 8/PG 2
HS 번호: 2917.19.7050
risk_code: 14-34
hazard_code: C
safety_code: 26-27-36/37/39-45
포장분류: II
위험 등급: 8
Hazard Classifications: Eye Dam. 1Skin Corr. 1B
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

응용 분야 · 1건

용도Suberoyl chloride is used as a reagent to synthesize hydroxyferrocifen hybrid compounds that have antiproliferative activity against triple negative breast cancer cells. It is also used as a cross-linking agent to cross-link Chitosan (C315015) membranes, and also improves the membranes integrity.