1,6-Diiodohexane

HCID 12373CAS 629-09-4

기본 정보

표준 SMILES: ICCCCCCI
InChIKey: QLIMAARBRDAYGQ-UHFFFAOYSA-N
분자식: C6H12I2
평균 분자량: 337.97 g/mol
단동위원소 질량: 337.90284638

이름 및 식별자

우선 이름: 1,6-Diiodohexane
IUPAC: 1,6-diiodohexane
영어명: 1,6-Diiodohexane
분자식: C6H12I2
분자량: 337.97

이름 및 동의어

1,6-DiiodohexaneHEXANE, 1,6-DIIODO-K4QL8HA5VYDTXSID9060865QLIMAARBRDAYGQ-UHFFFAOYSA-4-01-00-00356 (Beilstein Handbook Reference).ALPHA.,.OMEGA.-DIIODOHEXANERefChem:73598ALPHA,OMEGA-DIIODOHEXANEDTXCID4043567211-073-5InChI=1/C6H12I2/c7-5-3-1-2-4-6-8/h1-6H2

이름 더 보기

1,6-Iodohexane1,6-diiohexane1,6-diiodo-hexan1,6-Diiodihexane1,6-diiodohexanes1,6-diodiodhexaneHexane,1,6-diiodo-HEXAMETHYLENEIODIDE1,6-Diiodohexane,99+%

QLIMAARBRDAYGQ-UHFFFAOYSA-N629-09-4Hexamethylene diiodide1,6-diiodo hexaneEINECS 211-073-5MFCD00001103BRN 1280128C6H12I2

데이터베이스 식별자

CAS: 629-09-4
PubChem CID: 12373
DTXSID: DTXSID9060865
UNII: K4QL8HA5VY
EC Number: 211-073-5
Nikkaji: J135.082J

물성

구조 계산 물성

XLogP: 4.6
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 0
회전 가능 결합 수: 5
무거운 원자 수: 8
형식 전하: 0
복잡도: 31.5

실험 및 물리화학적 성질

SpringerMaterials PropertiesDensity

물리화학적 성질

녹는점: 9 · 9-10 °C (lit.)
끓는 점: 141 · 141-142 °C/10 mmHg (lit.)
밀도: 2.05 g/mL · 2.05 g/mL at 25 °C (lit.)
굴절률: 1.5852 · 1.5852-1.5872
인화점: 110 °C · >110°C
저장 조건: Keep in dark place,Inert atmosphere,Room temperature
물리적 상태: 액체
색상: 맑은 연한 노란색
수용성: 물과 섞이지 않습니다.
BRN: 1280128 · 1280128
InChI: InChI=1S/C6H12I2/c7-5-3-1-2-4-6-8/h1-6H2
InChIKey: QLIMAARBRDAYGQ-UHFFFAOYSA-N
SMILES: C(I)CCCCCI
EPA: 1 · Hexane, 1,6-diiodo- (629-09-4)

화학적 성질

clear light yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (97.9%): 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 48 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (97.9%)

안전 데이터

wgk: 3
tsca: TSCA listed
rtecs: MO1700000
ridadr: 2810
HS 번호: 29033990
risk_code: 36/37/38
hazard_code: Xi
safety_code: 37/39-26
포장분류: III
위험 등급: 6.1(b)
위험 참고 사항: Irritant
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 10 - Combustible liquids

화학 및 산업

용도 및 제조

General Manufacturing InformationHexane, 1,6-diiodo-: ACTIVE

응용 분야 · 1건

용도1,6-Diiodohexane is used as a precursor in the preparation of cationic tissue plasminogen activator (t-PA)-containing polyurethane surfaces. It is also used as a solvent additive and in potential power conversion efficiency of polymer or fullerene bulk heterojunction solar cells. Further, it is employed in the preparation of 3-(iodohexyl)-1-(3-(triethoxysilyl)propylcarbamoyl)-1H-benzo[d]imidazol-3-ium iodide and 2,4-dihydroxybenzophenone.