CAS 1515-80-6 Methyl sorbate (HCID 5323650)

이름 및 식별자

우선 이름: Methyl sorbate
IUPAC: methyl (2E,4E)-hexa-2,4-dienoate
영어명: Methyl sorbate
분자식: C7H10O2
분자량: 126.15

이름 및 동의어

Methyl sorbate689-89-4methyl (2E,4E)-hexa-2,4-dienoateSorbic acid, methyl esterMethyl (E,E)-sorbateMethyl (2E,4E)-hexadienoateFEMA No. 37142-trans,4-trans-Methyl sorbate2-trans-4-trans-Methyl sorbateMethyl trans,trans-sorbateMethyl (E,E)-hexa-2,4-dienoateMethyl sorbate, (E,E)-

이름 더 보기

methyl hexa-2,4-dienoateFEMA 3714Methyl Sorbate >METHYL 2,4-HEXADIENOATESORBIC ACID METHYL ESTERMETHYL SORBATE USP/EP/BPMETHYL T2 T4 HEXADIENOATE2,4-Hexadienoic acid methylmethyl (2E,4Z)-hexa-2,4-dienoate2,4-HEXADIENOIC ACID METHYL ESTER

Sorbic acid, methyl ester, (E,E)-METHYL SORBATE [FHFI]2,4-HEXADIENOIC ACID, METHYL ESTER, (E,E)-AI3-30202Methyl (E,E)-2,4-hexadienoateEINECS 211-712-8Methyl 2,4-hexadienoate, (E,E)-2,4-Hexadienoic acid, methyl ester, (2E,4E)-

데이터베이스 식별자

CAS: 1515-80-6、689-89-4
PubChem CID: 5323650
DTXSID: DTXSID30862370
ChEMBL: CHEMBL250421
ChEBI: CHEBI:184593
UNII: J3048615R1
EC Number: 211-712-8、216-160-1
Nikkaji: J184.214E、J45.089H

물성

구조 계산 물성

XLogP: 1.6
극성 표면적: 26.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 3
무거운 원자 수: 9
형식 전하: 0
복잡도: 134

실험 및 물리화학적 성질

Density0.933-0.938

Solubility · 2건

Slightly soluble in water; miscible in oils

soluble (in ethanol)

Boiling Point · 2건

180.00 °C. @ 760.00 mm Hg

180 °C

Melting Point5 °C

Refractive Index1.501-1.505

Physical Description · 2건

Liquid

colourless to light yellow liquid; fruity, sweet, anise aroma

물리화학적 성질

녹는점: 8 °C · 8°C
끓는 점: 180 °C · 180 °C(lit.)
밀도: 0.968 g/mL · 0.968 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.503(lit.)
인화점: 158 °F · 158 °F
저장 조건: Amber Vial, Refrigerator
용해도: 클로로포름(난용성), 에틸아세테이트, 메탄올 (약간 용해됨)
물리적 상태: 기름
색상: 무색
냄새: 달콤함, 과일향, 브라운, 매콤한 그린 아니스 뉘앙스
냄새 유형: 회향풀
LogP: 1.86 · 1.86

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 70% (91 of 130) of all reports.

Warning

H315 (30%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (30%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 130 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Reported as not meeting GHS hazard criteria per 91 of 130 reports by companies.；There is 1 notification provided by 39 of 130 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Regulatory Information · 3건

Chemical: 2,4-Hexadienoic acid, methyl ester, (E,E)-

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

2,4-Hexadienoic acid, methyl ester, (2E,4E)-: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - 2,4-Hexadienoic acid, methyl ester, (E,E)-: Human health tier I assessment

Hazard Classes and CategoriesSkin Irrit. 2 (30%)；Eye Irrit. 2 (30%)

규제 정보

Regulatory Information · 3건

Chemical: 2,4-Hexadienoic acid, methyl ester, (E,E)-

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

2,4-Hexadienoic acid, methyl ester, (2E,4E)-: Does not have an individual approval but may be used under an appropriate group standard

안전 데이터

wgk: 3
HS 번호: 2916199590
risk_code: 36/38
hazard_code: Xi
safety_code: 26-36
기존화학 물질: KE-24215

화학 및 산업

약리 정보

Cellular LocationsCytoplasm；Extracellular；Membrane

용도 및 제조

Use Classification · 3건

Fragrance Ingredients

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

General Manufacturing Information2,4-Hexadienoic acid, methyl ester, (2E,4E)-: INACTIVE

공급사57 곳

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

武汉鹏垒生物科技有限公司15871464247 · [email protected]

Shaanxi LonierHerb Bio Technology Co Ltd+86-86-+86-86-029-87551862 15002946897 · [email protected]

杭州品高化工有限公司0571-87658025 · [email protected]

화합물 노트

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Methyl sorbate

기본 정보