기본 정보
- CAS
7757-81-5- 표준 SMILES
C/C=C/C=C/C(=O)[O-].[Na+]- InChIKey
LROWVYNUWKVTCU-STWYSWDKSA-M- 분자식
- C6H7NaO2
- 평균 분자량
- 134.11 g/mol
- 단동위원소 질량
- 134.03437374
이름 및 식별자
- 우선 이름
- Sodium Sorbate
- IUPAC
- sodium (2E,4E)-hexa-2,4-dienoate
- 현지명
- 소듐솔베이트
- 영어명
- Sodium Sorbate
- 분자식
- C6H7NaO2
- 분자량
- 135.12
이름 및 동의어
SODIUM SORBATE7757-81-5Sorban sodnySorbic acid, sodium saltTGW6Q2CCVM2,4-Hexadienoic acid, sodium salt2,4-Hexadienoic acid, sodium salt, (E,E)-Sodium (E,E)-2,4-hexadienoateDTXSID8047181E 201RefChem:184099DTXCID6027181
이름 더 보기
소듐솔베이트sorbansodnySodiumSorbate>SORBIC ACID SODIUM SALTsodiumhexa-2,4-dienoateSODIUM 2,4-HEXADIENOATESodium Sorbate USP/EP/BPSORBIC ACID SODIUM SALT 98+%2,4-hexadienoicacid,sodiumsalt
231-819-3Sorbic Acid Sodium Saltsodium;(2E,4E)-hexa-2,4-dienoateMFCD00058995sodium (2E,4E)-hexa-2,4-dienoateSorban sodny [Czech]Sodium (E,E)-hexa-2,4-dienoateCCRIS 5163
데이터베이스 식별자
- CAS
7757-81-5- PubChem CID
- 23665582
- DTXSID
DTXSID8047181- UNII
- TGW6Q2CCVM
- EC Number
- 231-819-3
- Nikkaji
- J15.029K、J240.326I
물성
구조 계산 물성
- 극성 표면적
- 40.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 2
- 무거운 원자 수
- 9
- 형식 전하
- 0
- 복잡도
- 127
실험 및 물리화학적 성질
Chemical ClassesOther Uses -> Preservatives
CosmeticsPreservative
Food AdditivesANTIMICROBIAL AGENT -> FDA Substance added to food
DecompositionWhen heated to decomposition it emits acrid smoke and sodium oxide fumes.
Other Experimental PropertiesHYDROCARBON-LIKE ODOR IS OFTEN ASSOCIATED WITH SORBATES /SORBATES/
물리화학적 성질
- 수용성
- 물에 용해됨
- 물리적 상태
- powder to crystal
- 색상
- 흰색에서 밝은 노란색
- 화장품 원료 기능
- 항균 방부제
- InChI
- InChI=1S/C6H8O2.Na/c1-2-3-4-5-6(7)8;/h2-5H,1H3,(H,7,8);/q;+1/p-1/b3-2+,5-4+;
- InChIKey
- LROWVYNUWKVTCU-STWYSWDKSA-M
- SMILES
- C(/C([O-])=O)=C\C=C\C.[Na+]
- LogP
- 1.347 · 1.347 (est)
안전 및 규제
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 17.6% (3 of 17) of reports.
Warning
H319 (82.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 17 reports by companies from 3 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory InformationChemical: 2,4-Hexadienoic acid, sodium salt, (E,E)-
Other Safety InformationIMAP assessments - 2,4-Hexadienoic acid, sodium salt, (E,E)-: Environment tier I assessment
Hazards SummarySee Potassium sorbate, and Calcium sorbate.
FDA Requirements
Substances migrating to food from paper and paperboard products used in food packaging that are generally recognized as safe for their intended use include sodium sorbate.
Sodium sorbate used as a chemical preservative in food for human consumption is generally recognized as safe when used in accordance with good manufacturing practice.
Sodium sorbate used as a chemical preservative in animal drugs, feeds, and related products is generally recognized as safe when used in accordance with good manufacturing or feeding practice.
Hazard Classes and CategoriesEye Irrit. 2 (82.4%)
Explosive Limits and PotentialCombustible
독성 정보
Non-Human Toxicity ValuesLD50 Mouse ip 2500 mg/kg
화학 및 산업
약리 정보
Metabolism/Metabolites
... /RESEARCHERS/ ATTRIBUTED CONSUMPTION OF SORBIC ACID BY MOLDS TO BETA-OXIDATION ... SIMILAR TO THOSE IN MAMMALS. ... /OTHERS/ PROPOSED ... THAT PENICILLIA, PARTICULARLY P ROQUEFORTI, DEGRADE ... /IT/ BY DECARBOXYLATION TO 1,3-PENTADIENE. ... /ITS/ DIENE ... APPEARS TO PREVENT OXIDATION TO THE KETONE. /SORBIC ACID/
... METABOLIZED LIKE OTHER FATTY ACIDS IN ... /MAMMALS & BY MICROORGANISMS./ ... /IT/ DISAPPEARED FROM SEVERAL CULTURES OF CLOSTRIDIUM PARABOTULINUM. ... APPARENT UTILIZATION ... AFTER 7 DAYS INCUBATION @ 37 °C RANGED FROM 86-100% FOR STRAINS OF TYPES A & B & WAS 62% FOR NON-TOXIC STRAINS. /SORBIC ACID/
MeSH Pharmacological ClassificationSubstances capable of inhibiting, retarding or arresting the process of fermentation, acidification or other deterioration of foods.
용도 및 제조
Uses
Used as a preservative (control of mold and yeast) in food and cosmetics; [HSDB]
CHEMICAL PRESERVATIVE FOOD ADDITIVE
PRESERVATIVE FOR CONTROL OF MOLD & YEAST
Preservatives frequently used in cosmetic products /sorbates/
IN DERMATOLOGIC PAREPARATIONS
Methods of ManufacturingIT CAN BE MADE BY REACTING SORBIC ACID WITH AQ SODIUM HYDROXIDE. STOCK SOLN OF 20% SORBIC ACID EQUIVALENCE MAY BE PREPARED IN THIS MANNER.
Household ProductsInformation on 1 consumer products that contain Sodium sorbate in the following categories is provided:
Use Classification
Food Additives -> PRESERVATIVE -> JECFA Functional Classes
Cosmetics -> Preservative
General Manufacturing Information
... CLOSTRIDIA CELLS & SPORES RESIST CONCN OF SORBIC ACID WHICH ARE INHIBITORY TO MAJORITY OF OTHER BACTERIA TESTED. /SORBIC ACID/
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