기본 정보
- 표준 SMILES
CCCCCCCCC=CCCCCCCCC(=O)OC- InChIKey
QYDYPVFESGNLHU-UHFFFAOYSA-N- 분자식
- C19H36O2
- 평균 분자량
- 296.5 g/mol
- 단동위원소 질량
- 296.27153039
이름 및 식별자
- 우선 이름
- 9-Octadecenoic acid, methyl ester
- IUPAC
- methyl octadec-9-enoate
- 현지명
- 올레인산 메틸
- 영어명
- Methyl Oleate
- 분자식
- C19H36O2
- 분자량
- 296.49
이름 및 동의어
methyl octadec-9-enoateMethyl 9-octadecenoateEINECS 219-559-918:1n-9 methyl esterDTXSID9062435METHYL elaidic acidRefChem:108146Methyl octadec-9-enoic acidDTXCID4037110Methyl (9E)-octadec-9-enoic acid219-559-99-Octadecenoic acid, methyl ester
이름 더 보기
올레인산메틸올레인산메틸메틸올리에이트(Z)-9-옥타데센산 메틸 에스터메틸 9-옥타데켄오에이트올레인산 메틸METHYL OCTADECENOATEOLEIC ACID METHYL ESTERMETHYL CIS-9-OCTADECENOATE9-Octadecenoicacid(Z)-,methylestercis-octadec-9-enoicacidMethyl (9Z)-9-octadecenoatemethyl (9Z)-octadec-9-enoatecis-octadec-9-enoicacidmethylesterCIS-9-OCTADECENOIC ACID METHYL ESTERnsc406282
QYDYPVFESGNLHU-ZHACJKMWSA-N2462-84-2cis-oleic acid methyl estermethyl-9-octadecenoateOleic Acid-1-13C, Methyl Ester9-Octadecenoic Acid Methyl Ester; 9-Octadecenoic acid, methyl ester (7CI, 9CI, ACI); Methyl 9-octadecenoate; 9-Octadecenoic acid methyl esterEmerest 2219SCHEMBL37372
데이터베이스 식별자
- CAS
112-62-9、2462-84-2- PubChem CID
- 8202
- DTXSID
DTXSID9062435- ChEBI
CHEBI:229170- EC Number
- 219-559-9
물성
구조 계산 물성
- XLogP
- 7.6
- 극성 표면적
- 26.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 16
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 246
물리화학적 성질
- 녹는점
- -20 °C · -20 °C
- 끓는 점
- 218 °C/20 · 218 °C/20 mmHg (lit.)
- 밀도
- 0.874 g/mL · 0.874 g/mL at 20 °C (lit.)
- Pour Point
- -23 · -23
- 증기압
- 10 mm · 10 mm Hg ( 205 °C)
- 굴절률
- 20 · n20/D 1.452(lit.)
- 인화점
- 230 °F · >230 °F
- 저장 조건
- -20 °C · -20°C
- 용해도
- 클로로포름(약간 용해됨), DMSO(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 기름진 액체
- 색상
- 투명한 노란색에서 호박색까지
- Specific Gravity
- 0.875 · 0.875 (20/4℃)
- 냄새
- 100 · 100.00?%. 가벼운 지방
- 수용성
- 알코올, 에테르, 클로로포름과 섞임. 물과 섞이지 않습니다.
- Merck
- 14 · 14,6828
- BRN
- 1727037 · 1727037
- Henry's Law Constant
- 1.3 · 1.3×10-2 mol/(m3Pa) at 25℃, Krop and Velzen (1997)
- Dielectric constant
- 3.2 · 3.2(20℃)
- 안정성
- 안정적이지만 공기와 빛에 민감합니다. 강한 산화제와 호환되지 않습니다. 타기 쉬운.
- 화장품 원료 기능
- 피부 컨디셔닝 - 보습제피부 컨디셔닝향수
- InChI
- 1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h10-11H,3-9,12-18H2,1-2H3/b11-10-
- InChIKey
- QYDYPVFESGNLHU-KHPPLWFESA-N
- SMILES
- CCCCCCCC\C=C/CCCCCCCC(=O)OC
- LogP
- 7.45 · 7.450
- NIST
- 9 · 9-Octadecenoic acid (Z)-, methyl ester(112-62-9)
- EPA
- Methyl oleate (112-62-9)
화학적 성질
colourless liquid
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (4 of 4) of all reports.
Not Classified；Reported as not meeting GHS hazard criteria by 4 of 4 companies. For more detailed information, please visit ECHA C&L website.
Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 4 of 4 reports by companies.；There are 0 notifications provided by 0 of 4 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
유해성 정보
Regulatory Information
Chemical: 9-Octadecenoic acid, methyl ester
9-Octadecenoic acid, methyl ester: 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；Evaluation - Chemicals that are unlikely to require further regulation to manage risks to environment
Hazard Classes and CategoriesNot Classified
규제 정보
Regulatory Information
Chemical: 9-Octadecenoic acid, methyl ester
9-Octadecenoic acid, methyl ester: Does not have an individual approval but may be used under an appropriate group standard
안전 데이터
- wgk
- 1
- tsca
- TSCA listed
- rtecs
- RK0895000
- ridadr
- UN 1206 3/PG 2
- 독성
- LD50 orally in Rabbit: > 2000 mg/kg LD50 dermal Rabbit > 5000 mg/kg
- HS 번호
- 29161500
- risk_code
- 11-38-50/53-65-67
- hazard_code
- F,Xn,N
- safety_code
- 23-24/25-62-61-60-33-29-16-9
- 기존화학 물질
- KE-26495
- F 고인화성물질
- 8-23
- 스토리지 클래스
- 10 - Combustible liquids
- 유해 물질 데이터
- 112-62-9(Hazardous Substances Data)
화학 및 산업
용도 및 제조
Use ClassificationFragrance Ingredients
General Manufacturing Information9-Octadecenoic acid, methyl ester: ACTIVE
응용 분야
용도Methyl oleate is used as a chromatographic reference standard in biochemical research. It is also used as an intermediate for detergents, emulsifiers, wetting agents, stabilizers, textile treatments, plasticizers, for duplicating ink, rubber and wax. It finds application as lubricant and lubricant additive.
일반 설명Clear to amber liquid. Insoluble in water.
상·하류 제품 정보
상류 원료
하류 제품
공급사50 곳
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추가 설명
정의ChEBI: A fatty acid methyl ester resulting from the formal condensation of the carboxy group of oleic acid with methanol.
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