기본 정보
- CAS
104-64-3- 표준 SMILES
O=COCCCc1ccccc1- InChIKey
AMHRXSOVSAQOKL-UHFFFAOYSA-N- 분자식
- C10H12O2
- 평균 분자량
- 164.2 g/mol
- 단동위원소 질량
- 164.08372962
개요
3-Phenylpropyl formate is a member of benzenes.
이름 및 식별자
- 우선 이름
- 3-Phenylpropyl formate
- IUPAC
- 3-phenylpropyl formate
- 현지명
- 3-페닐프로필포름산염
- 영어명
- 3-Phenylpropyl formate
- 분자식
- C10H12O2
- 분자량
- 164.2
이름 및 동의어
3-Phenylpropyl formateHydrocinnamyl formateHydrocinnamyl methanoateBENZENEPROPANOL, FORMATE3-Phenyl-1-propyl formate3-Phenylpropyl methanoateBenzenepropanol, 1-formate1-Phenyl-3-formyloxypropanegamma-Phenylpropylformategamma-Phenylpropyl formate1-Propanol, 3-phenyl-, formateFEMA No. 2895
이름 더 보기
3-페닐프로필포름산염FEMA 2895PHENYLPROPYLFORMATEhydrocinnamylformate3-Phenylpropylformiatbenzenepropanol,formate3-phenyl-1-propylformate3-phenyl-1-propanoformate
.gamma.-PhenylpropylformateNSC 6010EINECS 203-222-8BRN 2501915UNII-6R8500G08YAI3-18532NSC-60106R8500G08Y
데이터베이스 식별자
- CAS
104-64-3- PubChem CID
- 61010
- DTXSID
DTXSID40861713- ChEBI
CHEBI:180396- UNII
물성
구조 계산 물성
- XLogP
- 2.9
- 극성 표면적
- 26.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 117
실험 및 물리화학적 성질
Food AdditivesFLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density1.012-1.019
Flavoring AgentsEU Flavoring substances
Solubility
insoluble in water
miscible (in ethanol)
Boiling Point
238.00 °C. @ 760.00 mm Hg
238 °C
Refractive Index1.494-1.499
Physical DescriptionColourless to slightly yellow liquid, pleasant, sweet, floral-herbaceous odour
물리화학적 성질
- 끓는 점
- 231.67 °C · 231.67°C (rough estimate)
- 밀도
- 1.0041 · 1.0041 (rough estimate)
- 굴절률
- 1.519 · 1.5190 (estimate)
- FEMA
- 2895 · 2895 | 3-PHENYLPROPYL FORMATE
- 냄새
- 100 %에서 · 100.00%에서. 달콤한 꽃 꿀 히아신스 계피
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% (234 of 234) of all reports.
Not Classified
Aggregated GHS information provided per 234 reports by companies from 1 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: Benzenepropanol, formate
Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)
Benzenepropanol, formate: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Benzenepropanol, formate: Environment tier I assessment
Hazard Classes and CategoriesNot Classified
안전 데이터
- tsca
- TSCA listed
- 독성
- The acute oral LD50 value in rats was reported as 4.09 ml/kg and the acute dermal LD50 value in rabbits exceeded 5 g/kg (Levenstein, 1975).
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
General Manufacturing InformationBenzenepropanol, 1-formate: INACTIVE
응용 분야
출처Has apparently not been reported to occur in nature.
용도3-Phenylpropyl formate is used in perfume compositions of the heavy-green type, e. g. Hyacinth, Narcissus, etc., and as a minor supporting note in Chypre or Oriental bases with Geranium, Styrax, Patchouli etc. Its effect is rather heavy and it needs considerable "blending" with light or fresh odorants in order to perform in a pleasant reamer.
제조 방법
Cold formulation of phenylpropyl alcohol.
공급사2 곳
上海问彩新材料科技有限公司15721586846 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
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