Heptyl butyrate

HCID 62592CAS 5870-93-9

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기본 정보

표준 SMILES
CCCCCCCOC(=O)CCC
InChIKey
JPQHLIYIQARLQM-UHFFFAOYSA-N
분자식
C11H22O2
평균 분자량
186.295 g/mol
단동위원소 질량
186.16197994

이름 및 식별자

우선 이름
Heptyl butyrate
IUPAC
Heptyl butanoate
영어명
HEPTYL BUTYRATE
분자식
C11H22O2
분자량
186.29

이름 및 동의어

FEMA 2549HeptylbutyratHETYL BUTYRATEheptylbutanoateHEPTYL BUTYRATEHeptyl butanoate1-HEPTYLBUTYRATEN-HEPTYL BUTYRATEHEPTYL-N-BUTYRATEn-Heptyl butanoate

데이터베이스 식별자

CAS
5870-93-9
PubChem CID
62592
DTXSID
DTXSID0042038
ChEMBL
CHEMBL3186512
ChEBI
CHEBI:179373
UNII
6YF38H29F1
EC Number
227-526-5
Nikkaji
J115.074J

물성

물리화학적 성질

녹는점
58 °C · −58 °C(lit.)
끓는 점
225 · 225-226 °C(lit.)
밀도
0.864 g/mL · 0.864 g/mL at 25 °C(lit.)
굴절률
20 · n20/D 1.4215(lit.)
FEMA
2549 · 2549 | HEPTYL BUTYRATE
인화점
195 °F · 195 °F

화학적 성질

Heptyl butyrate has a fruity, chamomile-like odor and a sweet, green, tea-like taste suggestive of plum.

안전 및 규제

안전 데이터

wgk
2
tsca
TSCA listed
rtecs
EK7876000
기존화학 물질
KE-03854
스토리지 클래스
10 - Combustible liquids

화학 및 산업

응용 분야 · 3건

개요Heptyl cinnamate has a green, leafy odor with a secondary hyacinth note. Heptyl cinnamate is prepared by esterification of nheptanol with cinnamic acid.

출처Reported found in fresh apple, grilled beef, fresh plum, plumcot and babaco fruit (Carica pentagona Heilborn)

용도could find use in perfume compositions, but it is rarely mentioned as a perfume material. It introduces interesting nuances in fruity-green topnote complexes for Chypre or Aldehyde-types, and it can be used as a modifier in “Cucumber”’ odor, sometimes called for in certain cosmetic preparations. It blends excellently with Clary Sage and with the new American Mentha citrata oils (Todd # 664 in particular). In flavor compositions, this ester adds freshness and fruity-green aroma to imitation Raspbemy, Apricot, Melon, Plum, and in floral and Violet type flavors. The concentration used is normally very low, about 0.5 to 3 ppm in the finished product.

제조 방법

From n-heptyl alcohol and butyric acid in the presence of HCl.

상·하류 제품 정보

상류 원료

공급사50 곳

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