트라이카프린

Tricaprin

HCID 69310CAS 621-71-6
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC)OC(=O)CCCCCCCCC
InChIKey
LADGBHLMCUINGV-UHFFFAOYSA-N
분자식
C33H62O6
평균 분자량
554.8 g/mol
단동위원소 질량
554.4546397

개요

Tricaprin is a triglyceride obtained by formal acylation of the three hydroxy groups of glycerol by capric (decanoic) acid. It is a triglyceride and a decanoate ester.

이름 및 식별자

우선 이름
Tricaprin
IUPAC
2,3-di(decanoyloxy)propyl decanoate
현지명
트라이카프린
영어명
TRICAPRIN
분자식
C33H62O6
분자량
554.84

이름 및 동의어

Tricaprin621-71-6TridecanoinGlycerol tricaprateGlycerol tridecanoateGlyceryl tricaprateCapric acid triglycerideGlycerol tricaprinTricapric glycerideDynasan 110Decanoic acid, 1,2,3-propanetriyl esterCapric triglyceride
이름 더 보기
트라이카프린TRYGLICERIDEGLYCERYL TRIDECANOATEGlyceryl tricaprinateCAPRINricaprindynasan110
2,3-di(decanoyloxy)propyl decanoate1,2,3-Propanol tridecanoateO1PB8EU98MDTXSID1042651NSC-147475PANACET 1000CAPTEX 1000CHEBI:77388

데이터베이스 식별자

CAS
621-71-6
PubChem CID
69310
DTXSID
DTXSID1042651
ChEBI
CHEBI:77388
UNII
O1PB8EU98M
EC Number
210-702-0
Nikkaji
J95.465I

물성

구조 계산 물성

XLogP
12.2
극성 표면적
78.9 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
6
회전 가능 결합 수
32
무거운 원자 수
39

실험 및 물리화학적 성질

LipidsLipids -> Glycerolipids [GL] -> Triradylglycerols [GL03] -> Triacylglycerols [GL0301]
Cosmetics · 3건

Cosmetic ingredients (Tricaprin) -> CIR (Cosmetic Ingredient Review)

Personal care product -> emollient

Emollient; Skin conditioning; Solvent

Physical DescriptionSolid

물리화학적 성질

녹는점
31 · 31-32 °C
끓는 점
254 °C · 254 °C / 5mmHg
밀도
0.98 g/ml · approximate 0.98 g/ml (20℃)
굴절률
1.44 · approximate 1.44
인화점
20 °C · 20 °C
저장 조건
-20 °C · -20°C

안전 및 규제

GHS 분류

GHS Classification · 3건

This chemical does not meet GHS hazard criteria for 100% (8 of 8) of all reports.

Not Classified

Aggregated GHS information provided per 8 reports by companies from 1 notifications to the ECHA C&L Inventory.

유해성 정보

Regulatory Information · 2건

Chemical: Decanoic acid, 1,2,3-propanetriyl ester

Decanoic acid, 1,2,3-propanetriyl ester: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Decanoic acid, 1,2,3-propanetriyl ester: Human health tier I assessment
Hazard Classes and CategoriesNot Classified

독성 정보

Toxicity SummarySafe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org

안전 데이터

wgk
-
tsca
TSCA listed
rtecs
HE0100000
ridadr
UN 1282 3/PG 2
HS 번호
29171900
risk_code
11-20/21/22

화학 및 산업

약리 정보

Cellular LocationsExtracellular
Metabolite PathwaysDe Novo Triacylglycerol Biosynthesis TG(10:0/10:0/10:0)

용도 및 제조

UsesCIR ingredient: Tricaprin
Use ClassificationCosmetics -> Emollient; Skin conditioning; Solvent
General Manufacturing InformationDecanoic acid, 1,1',1''-(1,2,3-propanetriyl) ester: ACTIVE
응용 분야 · 2건

개요1,2,3-Tridecanoyl glycerol is a triacylglycerol that contains decanoic acid at the sn-1, sn-2, and sn-3 positions. It has been found in human breast milk. 1,2,3-Tridecanoyl glycerol has been used as a standard for the quantification of triacylglycerols in fish oils by RP-HPLC. Formulations containing 1,2,3-tridecanoyl glycerol have been used in cosmetic products as thickening and skin-conditioning agents.

용도Tricaprin is used to construct solid lipid nanoparticles (SLNs) as delivery system for bromocriptine (B682600, Mesylate salt). It is also used in cationic SLNs to enhance p53 tumor suppressor gene transfer to lung cancer cells.

상·하류 제품 정보

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
广州纳珑化工有限公司13192879270; 13192879270 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]

추가 설명

정의ChEBI: A triglyceride obtained by formal acylation of the three hydroxy groups of glycerol by capric (decanoic) acid.

관련 반응

2건
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