2,5-디클로로-2,5-디메틸헥산

2,5-디클로로-2,5-디메틸헥산 · DCAD · 2,5-dichloro-2,5-dimethyl-hexan · NSC 408418 · 5-DIMETHYLHEXANE · 2,5-Dichlor-2,5-dimethylhexan · 2,5-Dichloro-2,5-dimethylhexane · 2,5-Dimethyl-2,5-dichlorohexane

https://huagongshe.com/ko/chemical/80360

식별자 및 물리적 특성

CAS No.	6223-78-5
분자식	C8H16Cl2
평균 분자량	183.12 g/mol
단동위원소 질량	182.06290587 g/mol
SMILES	CC(C)(Cl)CCC(C)(C)Cl
InChIKey	HSTAGCWQAIXJQM-UHFFFAOYSA-N
PubChem CID	80360
EC No.	228-310-3
DTXSID	DTXSID8064145
현지명	2,5-디클로로-2,5-디메틸헥산

화학 및 물리적 성질

XLogP	3.4
극성 표면적	0
수소 결합 공여자 수	0
수소 결합 수용자 수	0
회전 가능 결합 수	3
무거운 원자 수	10
형식 전하	0
복잡도	91.8
SpringerMaterials Properties	Surface tension
녹는점	63-64°C
끓는 점	221.51°C (estimate)
밀도	1.0333 (estimate)
굴절률	1.4345 (estimate)
저장 조건	under inert gas (nitrogen or Argon) at 2-8°C
용해도	클로로포름(약간 용해됨), 디클로로메탄, 디에틸 에테르에틸아세테이트, 메탄올에 용해됨
물리적 상태	고체
색상	흰색에서 옅은 베이지까지
InChI	InChI=1S/C8H16Cl2/c1-7(2,9)5-6-8(3,4)10/h5-6H2,1-4H3
InChIKey	HSTAGCWQAIXJQM-UHFFFAOYSA-N
SMILES	CC(Cl)(C)CCC(Cl)(C)C
EPA	Hexane, 2,5-dichloro-2,5-dimethyl- (6223-78-5)

화학적 성질

White Solid

안전 및 규제

GHS 분류	WarningH302+H312+H332 (33.3%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oralacute toxicity, dermalacute toxicity, inhalation]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
규제 정보	Chemical: Hexane, 2,5-dichloro-2,5-dimethyl-
기타 안전 정보	Evaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and Categories	Acute Tox. 4 (66.7%)
TSCA 등재 상태	TSCA listed
관세 코드	2903190090
위험 문구(R)	36/37/38
안전 문구(S)	26-36/37/39

용도

2,5-Dichloro-2,5-dimethylhexane is a useful reagent for the preparation of substituted bis-2-indenyl metallocene compounds as catalysts for olefin polymerization.