기본 정보
- CAS
10402-52-5- 표준 SMILES
CC(=O)OCC(C)c1ccccc1- InChIKey
RVPTTWAAIKMYAH-UHFFFAOYSA-N- 분자식
- C11H14O2
- 평균 분자량
- 178.23 g/mol
- 단동위원소 질량
- 178.09937969
개요
2-Phenylpropyl acetate is a member of benzenes.
이름 및 식별자
- 우선 이름
- Benzeneethanol, beta-methyl-, 1-acetate
- IUPAC
- 2-phenylpropyl acetate
- 영어명
- 2-Phenylpropyl acetate
- 분자식
- C11H14O2
- 분자량
- 178.23
이름 및 동의어
2-Phenylpropyl acetate10402-52-5Benzeneethanol, beta-methyl-, acetateBenzeneethanol, beta-methyl-, 1-acetateDTXSID40864264RefChem:89102DTXCID60812803233-871-2Hydratropic acetateHydratropyl acetateBenzeneethanol, .beta.-methyl-, acetatebeta-Methylphenylethyl acetate
이름 더 보기
2-phenylpropyl2-Phenylpropylacetat2-PHENYL PROPYL ACETATE2-Phenyl-1-Propyl Acetate2-Phenyl-1-propanol acetatebeta-methylphenylethylacetateAcetic acid 2-phenylpropyl ester
EINECS 233-871-2NSC 190972AI3-355772-phenylpropylacetatePhenethyl alcohol, .beta.-methyl-, acetatebeta-Methylphenethyl acetatePHENETHYL ALCOHOL, beta-METHYL-, ACETATE.beta.-Phenylpropyl acetate
데이터베이스 식별자
- CAS
10402-52-5- PubChem CID
- 25239
- DTXSID
DTXSID40864264- ChEBI
CHEBI:81259- EC Number
- 233-871-2
물성
구조 계산 물성
- XLogP
- 2.4
- 극성 표면적
- 26.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 13
- 형식 전하
- 0
- 복잡도
- 159
물리화학적 성질
- 끓는 점
- 270.46 °C · 270.46°C (rough estimate)
- 밀도
- 1.0292 · 1.0292 (rough estimate)
- 굴절률
- 1.5103 · 1.5103 (estimate)
- 색상
- 무색의 액체.
- 냄새
- 100 %에서 · 100.00%에서. 달콤한 히아신스 라일락 녹색 흙빛
- 냄새 유형
- 꽃향기
- 화장품 원료 기능
- 향수
- LogP
- 2.652 · 2.652 (est)
- NIST
- Benzeneethanol, «beta»-methyl-, acetate(10402-52-5)
- EPA
- Benzeneethanol, .beta.-methyl-, acetate (10402-52-5)
화학적 성질
Colorless liquid. Sp.Gr. 1.07. Almost insoluble in water, soluble in alcohol, miscible with oils. Fairly soluble in Propylene glycol. Fresh-floral, powerful and fruity-green, slightly earthy-green odor more delicate than Phenylethylacetate, not as rosy, more Hyacinth-Lilac-like. Irsspite of its power, or rather “lift”, its effect is almost a delicate one, enabling the perfumer to use 2-4-6% of this ester in floral bases where green or greenearthy or spicy notes are already composed or called for.
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% (89 of 89) of all reports.
Not Classified
Aggregated GHS information provided per 89 reports by companies from 1 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory Information
Chemical: Benzeneethanol, .beta.-methyl-, acetate
Benzeneethanol, .beta.-methyl-, acetate: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesNot Classified
안전 데이터
- tsca
- TSCA listed
- 독성
- The acute oral LD50 value in rats was reported as 4.3g/kg (3.46-5.14 g/kg) and the acute dermal LD50 value in rabbits exceeded 5 g/kg (Moreno, 1975).
화학 및 산업
용도 및 제조
General Manufacturing InformationBenzeneethanol, .beta.-methyl-, 1-acetate: ACTIVE
응용 분야
출처Has apparently not been reported to occur in nature.
제조 방법
By direct esterification of hydratropyl alcohol with acetic acid under azeotropic conditions, or with acetic anhydride (Arctander, 1969).
공급사11 곳
Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
BOC Sciences[email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
上海问彩新材料科技有限公司15721586846 · [email protected]
重庆卡兰医药有限公司[email protected]
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