기본 정보
- CAS
61295-51-0- 표준 SMILES
Cc1occc1SC(C(=O)CC(C)C)C(C)C- InChIKey
PFFLSEMCPNTWOY-UHFFFAOYSA-N- 분자식
- C14H22O2S
- 평균 분자량
- 254.39 g/mol
- 단동위원소 질량
- 254.13405111
개요
2,6-Dimethyl-3-[(2-methyl-3-furanyl)thio]-4-heptanone is an aryl sulfide.
이름 및 식별자
- 우선 이름
- 2,6-Dimethyl-3-[(2-methyl-3-furyl)thio]-4-heptanone
- IUPAC
- 2,6-dimethyl-3-(2-methylfuran-3-yl)sulfanylheptan-4-one
- 영어명
- 2,6-dimethyl-3-[(2-methyl-3-furyl)thio]heptan-4-one
- 분자식
- C14H22O2S
- 분자량
- 254.39
이름 및 동의어
2,6-Dimethyl-3-((2-methyl-3-furyl)thio)-4-heptanoneFEMA No. 35382,6-Dimethyl-3-[(2-methyl-3-furyl)thio]heptan-4-one1,3-Diisopropylacetonyl 2-methyl-3-furyl sulfide3-((2-Methyl-3-furyl)thio)-2,6-dimethyl-4-heptanone2,6-Dimethyl-3-[(2-methyl-3-furanyl)thio]-4-heptanoneEINECS 262-692-272879F3Z2G2,6-Dimethyl-3-((2-methyl-3-furyl)thio)heptan-4-one2,6-dimethyl-3-[(2-methylfuran-3-yl)sulfanyl]heptan-4-one4-Heptanone, 2,6-dimethyl-3-((2-methyl-3-furanyl)thio)-4-Heptanone, 2,6-dimethyl-3-[(2-methyl-3-furanyl)thio]-
이름 더 보기
2,6-Dimethyl-3-((2-methyl-3-furanyl)thio)-4-Heptanone2,6-DIMETHYL-3-((2-METHYL-3-FURYL)THIO)-4-HEPTANONE [FHFI]2,6-Dimethyl-3-[(2-methyl-3-furyl)thio]-4-heptanone2,6-dimethyl-3-((2-methylfuran-3-yl)sulfanyl)heptan-4-oneRefChem:4456624-Heptanone, 2,6-dimethyl-3-(2-methyl-3-furanyl)thio-(+-)-2,6-DIMETHYL-3-((2-METHYL-3-FURYL)THIO)-4-HEPTANONE61295-51-0
데이터베이스 식별자
- CAS
물성
구조 계산 물성
- XLogP
- 4.3
- 극성 표면적
- 55.5 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 17
- 형식 전하
- 0
- 복잡도
- 251
실험 및 물리화학적 성질
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density1.006-1.022
Flavoring AgentsEU Flavoring substances
Solubility
Insoluble in water; soluble in fat
Miscible at room temperature (in ethanol)
Boiling Point
90.00 to 92.00 °C. @ 0.20 mm Hg
90-92 °C (0.2 mm Hg)
Refractive Index1.488-1.494
Physical DescriptionLiquid; meat-like odour
물리화학적 성질
- FEMA
- 3538 · 3538 | 2,6-DIMETHYL-3-((2-METHYL-3-FURYL)THIO)-4-HEPTANONE
- 냄새
- 고기맛
- 냄새 유형
- 고기가 많은
- JECFA Number
- 1086 · 1086
- LogP
- 4.29 · 4.29
화학적 성질
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory Information
Chemical: 4-Heptanone, 2,6-dimethyl-3-[(2-methyl-3-furanyl)thio]-
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
4-Heptanone, 2,6-dimethyl-3-(2-methyl-3-furanyl)thio-: Does not have an individual approval but may be used under an appropriate group standard
화학 및 산업
약리 정보
Cellular LocationsMembrane
용도 및 제조
Use Classification
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
공급사1 곳
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
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