기본 정보
- CAS
13481-87-3- 표준 SMILES
CCCCCC=CCC(=O)OC- InChIKey
MTDCXFZGUVZRSQ-UHFFFAOYSA-N- 분자식
- C10H18O2
- 평균 분자량
- 170.25 g/mol
- 단동위원소 질량
- 170.13067981
이름 및 식별자
- 우선 이름
- Methyl 3-nonenoate
- IUPAC
- methyl non-3-enoate
- 영어명
- FEMA 3710
- 분자식
- C10H18O2
- 분자량
- 170.25
이름 및 동의어
Methyl 3-nonenoateMethyl non-3-enoate13481-87-33-Nonenoic acid, methyl esterDTXSID10476592M3M6634B7DTXCID9027659METHYL 3-NONENOATE [FHFI]RefChem:815597methyl (E)-3-nonenoateEINECS 236-786-9SCHEMBL874553
이름 더 보기
FEMA 3710Fema no. 3710Methyl nonenateMethyl nonenoateMethylnon-3-enoatMETHYL T3 NONENOATEFEMA 3710 USP/EP/BP
CHEMBL3183304SCHEMBL16288317UNII-2M3M6634B7DB-042253NS00086376
데이터베이스 식별자
- CAS
13481-87-3- PubChem CID
- 61631
- DTXSID
DTXSID1047659- ChEMBL
CHEMBL3183304- EC Number
- 236-786-9
물성
구조 계산 물성
- XLogP
- 3.2
- 극성 표면적
- 26.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 139
실험 및 물리화학적 성질
Density0.880-0.900 (20 °C)
Solubility
insoluble in water
(in ethanol)
Boiling Point90 °C (18 mmHg)
Refractive Index1.432-1.442
Physical Descriptionclear, colourless liquid
물리화학적 성질
- 끓는 점
- 212.7 · 212.7±9.0 °C(Predicted)
- 밀도
- 0.885 g/mL · 0.885 g/mL at 25 °C(lit.)
- FEMA
- 3710 · 3710 | METHYL 3-NONENOATE
- 굴절률
- 20 · n20/D 1.436(lit.)
- 인화점
- 191 °F · 191 °F
- 냄새
- 100 %에서 · 100.00%에서. 과일향이 나는 녹색 수박 껍질 배 껍질 단물 즙이 많고 지방이 많음 건조함
- 냄새 유형
- 과일 같은
- 생물학적 소스
- synthetic
- JECFA Number
- 340 · 340
- 주요 응용
- 향료 및 향
- 화장품 원료 기능
- 향수
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 100% (93 of 93) of all reports.
Not Classified；Reported as not meeting GHS hazard criteria by 93 of 93 companies. For more detailed information, please visit ECHA C&L website.
Aggregated GHS information provided per 93 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 93 of 93 reports by companies.；There are 0 notifications provided by 0 of 93 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: 3-Nonenoic acid, methyl ester
3-Nonenoic acid, methyl ester: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - 3-Nonenoic acid, methyl ester: Environment tier I assessment；IMAP assessments - 3-Nonenoic acid, methyl ester: Human health tier I assessment
Hazard Classes and CategoriesNot Classified
규제 정보
Regulatory Information
Chemical: 3-Nonenoic acid, methyl ester
3-Nonenoic acid, methyl ester: Does not have an individual approval but may be used under an appropriate group standard
안전 데이터
화학 및 산업
용도 및 제조
Use Classification
Fragrance Ingredients
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
General Manufacturing Information3-Nonenoic acid, methyl ester: ACTIVE
응용 분야
개요Methyl 3-nonenoate has a watermelon-like odor.
출처Reported found in hop oil and guava
상·하류 제품 정보
상류 원료
공급사60 곳
Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]
Hebei baicao biology science and technology co., ltd+86-19131911055 17824879454 · [email protected]
巨野众悦香料有限公司0530-8599699 13701896116 · [email protected]
广州纳珑化工有限公司13192879270; 13192879270 · [email protected]
山东海舟生物工程有限公司130-0567-0367 13006570367 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
河南闰霖化工有限公司+86-18738066252; +86-18738066252 · [email protected]
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