1,10-데칸디올
1,10-Decanediol
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기본 정보
- CAS
112-47-0- 표준 SMILES
OCCCCCCCCCCO- InChIKey
FOTKYAAJKYLFFN-UHFFFAOYSA-N- 분자식
- C10H22O2
- 평균 분자량
- 174.28 g/mol
- 단동위원소 질량
- 174.16197994
개요
1,10-decanediol has been reported in Perilla frutescens with data available.
이름 및 식별자
- 우선 이름
- 1,10-Decanediol
- IUPAC
- decane-1,10-diol
- 현지명
- 1,10-데칸디올
- 영어명
- 1,10-Decanediol
- 분자식
- C10H22O2
- 분자량
- 174.28
이름 및 동의어
1,10-Decanediol112-47-0Decamethylene glycolDecamethylenediol1,10-Dihydroxydecane1,10-Decamethylenediolalpha,omega-Decanediol5I577UDK52NSC-17165SPEZIOL C 10/2DTXSID3059420RefChem:71143
이름 더 보기
1,10-데칸디올1,10-데칸다이올DecanediolNSC406706NSC 406706NSC-406706Cetanediol10-Decanediol1,10-Decadiol1,10-Decandiol1, 10 - decane
DTXCID4033261203-975-2Decane-1,10-diol1,10-Decamethylene diol1,6-Bis(2-hydroxyethyl)hexane.alpha.,.omega.-DecanediolNSC 17165MFCD00004749
데이터베이스 식별자
- CAS
112-47-0- PubChem CID
- 37153
- DTXSID
DTXSID3059420- UNII
- 5I577UDK52
- EC Number
- 203-975-2
- Nikkaji
- J10.105B
물성
구조 계산 물성보충 중
- XLogP
- 2.5
- 극성 표면적
- 40.5 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 64.2
실험 및 물리화학적 성질
PolymersOther Classes -> Alcohols and Polyols, Other
CosmeticsCosmetic ingredients (1,10-Decanediol) -> CIR (Cosmetic Ingredient Review)
SpringerMaterials PropertiesDensity
Physical Description
Liquid
Solid; [Merck Index] White solid; [Sigma-Aldrich MSDS]
물리화학적 성질
- 녹는점
- 70 · 70-73 °C
- 끓는 점
- 297 °C · 297 °C
- 밀도
- 1 · 1,08 g/cm3
- 증기압
- 0.1 hPa · <0.1 hPa (20 °C)
- 굴절률
- 1.4603 · 1.4603 (estimate)
- 인화점
- 152 °C · 152 °C
- 저장 조건
- 30 °C · Store below +30°C.
- 용해도
- 0.7 g/L · 0.7g/L
- 물리적 상태
- 펠릿 또는 플레이크 및/또는 분말
- 산도 계수 (pKa)
- 14.89 · 14.89±0.10(Predicted)
- 색상
- 하얀색
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 99.3% (148 of 149) of all reports.
Not Classified
Aggregated GHS information provided per 149 reports by companies from 2 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: 1,10-Decanediol
1,10-Decanediol is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,10-Decanediol 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: 20-09-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/19334
1,10-Decanediol: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to human health
Hazards SummaryIntraperitoneal lethal-dose (mouse) > 500 mg/kg; [RTECS] May cause irritation; [Sigma-Aldrich MSDS] See 1-Decanol.
Hazard Classes and CategoriesNot Classified
독성 정보
Toxicity SummarySafe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org
안전 데이터
- wgk
- 1
화학 및 산업
용도 및 제조
Uses
CIR ingredient: 1,10-Decanediol
Used as an intermediate in organic synthesis; [ExPub: EPA - TSCATS]
U.S. Production2023: <50,000 lb
Industry UsesIntermediate
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
1,10-Decanediol: ACTIVE
응용 분야
용도1,10-Decanediol is an minor intermediate in the production of polyesters. It also used in essence, perfumes and in pharmaceuticals. The diacrylate is hydrophobic and used for flexible dental materials, radiation curable coatings, and for lenses.
제조 방법
1,10-Decanediol is produced from sebacic acid by a hydrogenation process analogous to that described for 1,6-hexanediol.
상·하류 제품 정보
상류 원료
관련 반응
35건
화합물 노트
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