베헤닐베헤네이트

Behenyl Behenate

HCID 87221

기본 정보

CAS: 17671-27-1
표준 SMILES: CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCCCCCCC
InChIKey: NJIMZDGGLTUCPX-UHFFFAOYSA-N
분자식: C44H88O2
평균 분자량: 649.2 g/mol
단동위원소 질량: 648.67843205

개요

The CIR Expert Panel concluded that the alkyl esters, listed subsequently, are safe in the present practices of use and concentration described in this safety assessment when formulated to be non-irritating.

이름 및 식별자

우선 이름: Behenyl Behenate
IUPAC: docosyl docosanoate
현지명: 베헤닐베헤네이트
영어명: BEHENYL BEHENATE
분자식: C44H88O2
분자량: 649.17

이름 및 동의어

Behenyl behenateDocosyl docosanoateDocosanoic acid, docosyl esterdocosanyl docosanoatedocosyl behenatePelemol BBStarfol BBUNII-K8NU647RJ0K8NU647RJ0EINECS 241-646-5Behenic acid behenyl esterDTXSID0066242

이름 더 보기

베헤닐베헤네이트DocosyldocosanoatBehenyl Behenate，99%Docosanoicacid,docosylesterBehenyl Behenate(C22:0-C22:0)behenicacidbehenylestercrystalline

EC 241-646-5WE(22:0/22:0)RefChem:116886BEHENYL BEHENATE [INCI]DTXCID4035625NJIMZDGGLTUCPX-UHFFFAOYSA-N17671-27-1Docosanoic acid,docosyl ester

데이터베이스 식별자

CAS: 17671-27-1
PubChem CID: 87221
DTXSID: DTXSID0066242
UNII: K8NU647RJ0
EC Number: 241-646-5
Nikkaji: J287.109B

물성

구조 계산 물성

XLogP: 21.7
극성 표면적: 26.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 42
무거운 원자 수: 46
형식 전하: 0
복잡도: 544

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Esters, Other

LipidsFatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]

Cosmetics · 2건

Cosmetic ingredients (Behenyl Behenate) -> CIR (Cosmetic Ingredient Review)

Emollient

Physical Description · 2건

Dry Powder; Large Crystals; Dry Powder; Large Crystals; CBI

Solid; [Sigma-Aldrich MSDS]

물리화학적 성질

녹는점: 75 °C · 75 °C
끓는 점: 627.1 · 627.1±23.0 °C(Predicted)
밀도: 0.856 · 0.856±0.06 g/cm3(Predicted)
증기압: 0 Pa · 0Pa at 20℃
저장 조건: 20 °C · −20°C
화장품 원료 기능: 피부 컨디셔닝피부 컨디셔닝 - 보습제
LogP: 20.51 · 20.51
EPA: Behenyl behenate (17671-27-1)

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 3건

This chemical does not meet GHS hazard criteria for 100% (221 of 221) of all reports.

Not Classified

Aggregated GHS information provided per 221 reports by companies from 1 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory Information · 4건

Chemical: Docosanoic acid, docosyl ester

Docosanoic acid, docosyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Docosanoic acid, docosyl ester 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)

REACH registered substance: Docosyl docosanoate (EC: 241-646-5)

Docosanoic acid, docosyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Other Safety InformationIMAP assessments - Docosanoic acid, docosyl ester: Human health tier I assessment

Hazards SummaryMay cause irritation; [Sigma-Aldrich MSDS]

Hazard Classes and CategoriesNot Classified

독성 정보

Toxicity Summary · 2건

Safe for use in cosmetics, with qualifications

안전 데이터

화학 및 산업

용도 및 제조

UsesCIR ingredient: Behenyl Behenate

U.S. Production2023: 1,000,000 - <2,500,000 lb

Consumer UsesPigment

Industry UsesOther

Use ClassificationCosmetics -> Emollient

General Manufacturing Information · 2건

All Other Chemical Product and Preparation Manufacturing

Docosanoic acid, docosyl ester: ACTIVE

공급사50 곳

北京华美互利生物化工010-56205725 · [email protected]

深圳市星凯越生物科技有限公司0755-18589069862 18589069862 · [email protected]

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

湖北鑫杰成化工科技有限公司13554075426 · [email protected]

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]

화합물 노트

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기본 정보

CAS: 17671-27-1
표준 SMILES: CCCCCCCCCCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCCCCCCCCCCC
InChIKey: NJIMZDGGLTUCPX-UHFFFAOYSA-N
분자식: C44H88O2
평균 분자량: 649.2 g/mol
단동위원소 질량: 648.67843205

개요