기본 정보
- CAS
2163-00-0- 표준 SMILES
ClCCCCCCCl- InChIKey
OVISMSJCKCDOPU-UHFFFAOYSA-N- 분자식
- C6H12Cl2
- 평균 분자량
- 155.06 g/mol
- 단동위원소 질량
- 154.03160574
개요
1,6-dichlorohexane is a colorless liquid. (USCG, 1999)
이름 및 식별자
- 우선 이름
- 1,6-Dichlorohexane
- IUPAC
- 1,6-dichlorohexane
- 현지명
- 1,6-디클로로헥산
- 영어명
- 1,6-Dichlorohexane
- 분자식
- C6H12Cl2
- 분자량
- 155.07
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
2163-00-0- PubChem CID
- 16551
- DTXSID
DTXSID9044409- ChEMBL
CHEMBL3183456- UNII
- YK75382Q85
- EC Number
- 218-491-7
- Nikkaji
- J7.340G
물성
구조 계산 물성
- XLogP
- 2.8
- 극성 표면적
- 0 Ų
- 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
Density
1.068 at 68 °F (USCG, 1999) - Denser than water; will sink
1.068 @25 °C
Physical Description
1,6-dichlorohexane is a colorless liquid. (USCG, 1999)
Liquid
Colorless liquid; [CAMEO] Clear slightly yellow liquid; [Sigma-Aldrich MSDS]
물리화학적 성질
- 녹는점
- -13 °C · -13 °C
- 끓는 점
- 87 · 87-90 °C/15 mmHg (lit.)
- 밀도
- 1.068 g/mL · 1.068 g/mL at 25 °C (lit.)
- 증기압
- 11.3 Pa · 11.3Pa at 20℃
- 굴절률
- 20 · n20/D 1.457(lit.)
- 인화점
- 165 °F · 165 °F
- 저장 조건
- Inert atmosphere,Room Temperature
- 용해도
- 57 mg/L · 57mg/L
- 물리적 상태
- 투명한 액체
- 색상
- 무색 내지 거의 무색
- 수소이온지수(pH)
- 6 · 6-7 (H2O, 20℃)
- 폭발한계
- 5.3 · 5.3-10.5%(V)
- 수용성
- 난용성
- BRN
- 773673 · 773673
- Dielectric constant
- 8.79 · 8.7899999999999991
- InChI
- 1S/C6H12Cl2/c7-5-3-1-2-4-6-8/h1-6H2
- InChIKey
- OVISMSJCKCDOPU-UHFFFAOYSA-N
- SMILES
- ClCCCCCCCl
- LogP
- 3.5 at · 3.5 at 25℃
- NIST
- 1 · 1,6-Dichlorohexane(2163-00-0)
- EPA
- 1 · Hexane, 1,6-dichloro- (2163-00-0)
화학적 성질
Clear colourless liquid
안전 및 규제
GHS 분류
GHS Classification
Danger
H304 (65.2%): May be fatal if swallowed and enters airways [Danger Aspiration hazard]
P261, P264, P264+P265, P271, P273, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P331, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 164 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: Hexane, 1,6-dichloro-
Hexane, 1,6-dichloro- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Hexane, 1,6-dichloro- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 18-05-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/5784
1,6-Dichlorohexane: Does not have an individual approval but may be used under an appropriate group standard
Hazards Summary
May cause smarting and reddening of skin if spilled and allowed to remain on clothes; High vapor concentrations may cause mild smarting of eyes and respiratory system; [CHRIS] A skin irritant; [ECHA REACH Registrations] An irritant; [Sigma-Aldrich MSDS] See n-Butyl chloride.
Reactivity Profile
1,6-DICHLOROHEXANE is incompatible with strong oxidizing and reducing agents. Also incompatible with many amines, nitrides, azo/diazo compounds, alkali metals, and epoxides. Irritating vapors and toxic gases, such as hydrogen chloride and carbon monoxide, may be formed when involved in fire (USCG, 1999).
DOT Hazard Classification
1,6-Dichlorohexane
Marine pollutant
안전 및 보호
Protective Action Criteria (PAC)
12 [ppm]
130 [ppm]
790 [ppm]
안전 데이터
- wgk
- 1
- tsca
- TSCA listed
- ridadr
- UN 3082 9/PG 3
- HS 번호
- 29031980
- risk_code
- 36/37/38-53-52/53-51/53
- hazard_code
- Xi,N
- safety_code
- 26-36-61-37/39
- 포장분류
- III
- 위험 등급
- 9
- 기존화학 물질
- 2004-3-2838
- Hazard Classifications
- Aquatic Chronic 2Asp. Tox. 1Skin Irrit. 2
- 스토리지 클래스
- 10 - Combustible liquids
화학 및 산업
용도 및 제조
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Hexane, 1,6-dichloro-: ACTIVE
응용 분야
일반 설명Colorless liquid.
상·하류 제품 정보
하류 제품
공급사100 곳
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