사이클로펜타데카논

Cyclopentadecanone

HCID 10409CAS 502-72-7

기본 정보

표준 SMILES
O=C1CCCCCCCCCCCCCC1
InChIKey
OSOIQJGOYGSIMF-UHFFFAOYSA-N
분자식
C15H28O
평균 분자량
224.38 g/mol
단동위원소 질량
224.21401552

개요

Cyclopentadecanone has been reported in Angelica gigas with data available.

이름 및 식별자

우선 이름
Cyclopentadecanone
IUPAC
cyclopentadecanone
현지명
사이클로펜타데카논
영어명
Cyclopentadecanone
분자식
C15H28O
분자량
224.38

이름 및 동의어

CYCLOPENTADECANONE502-72-7ExaltoneNormusconeNormusconEINECS 207-951-2DTXSID2047141UNII-T09G246LETNSC 63900BRN 1618444T09G246LETAI3-37209
이름 더 보기
사이클로펜타데카논사이클로펜타데칸온MUSK 15exaltonCYCLOPENTADECONECyclopentadecanonCYCLOPENTANDECANONEExaltone~Normuscone
NSC-63900DTXCID0027141CPE-2184-07-00-00113 (Beilstein Handbook Reference)RefChem:129832CYCLOPENTADECANONE [INCI]207-951-2OSOIQJGOYGSIMF-UHFFFAOYSA-N

데이터베이스 식별자

CAS
502-72-7
PubChem CID
10409
DTXSID
DTXSID2047141
ChEMBL
CHEMBL3188770
UNII
T09G246LET
EC Number
207-951-2
Nikkaji
J4.478D

물성

구조 계산 물성

XLogP
5.8
극성 표면적
17.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
0
무거운 원자 수
16

실험 및 물리화학적 성질

SpringerMaterials PropertiesOptical coefficient
FragrancesFragrance Ingredient (Cyclopentadecanone) -> IFRA transparency List
Physical DescriptionLiquid

물리화학적 성질

녹는점
63 · 63-65 °C (lit.)
끓는 점
120 °C/0.3 · 120 °C/0.3 mmHg (lit.)
밀도
0.897 g/mL · 0.897 g/mL at 25 °C (lit.)
증기압
0.009 Pa · 0.009Pa at 40℃
굴절률
1.4637 · 1.4637 (estimate)
인화점
120 °C/0.3mm · 120°C/0.3mm
화학적 성질 · 1건

Cyclopentadecanone is a musk fragrance found in the scent gland of the male civet cat. A number of syntheses have been developed for its manufacture [260]. Among these, the so-called Story procedure is the only route that has the potential to make cyclopentadecanone available on a larger scale, but due to the handling of hydroperoxides, the process is difficult to manage. The process starts from tricyclohexylidene triperoxide, which is obtained by oxidation of cyclohexanone with hydrogen peroxide. Pyrolysis leads to a mixture of 1,16-hexadecanolide and cyclopentadecane. The latter is oxidized by oxygen under boric acid catalysis to cyclopentadecanol, which is subsequently oxidized to cyclopentadecanone. Due to the availability of long-chained aliphatic dicarboxylic acids by biotechnological processes, a Dieckmann condensation reaction may also possibly be a useful route to produce this macrocyclic ketone. Cyclopentadecanone is used in fine fragrances:

안전 및 규제

GHS 분류

GHS Classification · 3건

This chemical does not meet GHS hazard criteria for 96.2% (1372 of 1426) of all reports.

Not Classified

Aggregated GHS information provided per 1426 reports by companies from 5 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory Information · 4건

Chemical: Cyclopentadecanone

Cyclopentadecanone is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Cyclopentadecanone are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 08-01-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/24075

Cyclopentadecanone: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationEvaluation - Exaltone and related macrocyclic musks
Hazard Classes and CategoriesNot Classified

안전 데이터

wgk
2
tsca
TSCA listed
rtecs
GY0900000
HS 번호
29142900
safety_code
22-24/25
기존화학 물질
KE-09294

화학 및 산업

용도 및 제조

U.S. Production2023: 84,644 lb
Consumer UsesFragrance
Industry UsesFragrance
Household ProductsInformation on 2 consumer products that contain Cyclopentadecanone in the following categories is provided:
Use ClassificationFragrance Ingredients
General Manufacturing Information · 2건

Soap, Cleaning Compound, and Toilet Preparation Manufacturing

Cyclopentadecanone: ACTIVE

응용 분야

출처Reported to be found in the scent glands of the Louisiana muskrat Ondatra zibethicus rivalicius (Guenther, 1949).

용도Cyclopentadecanone is the main odoriferous component of musk.

제조 방법

By the cyclization of dinitriles in high dilution (Bedoukian. 1967).

상·하류 제품 정보

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

관련 반응

30건

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