케토이소카프로에이트나트륨

Sodium 4-methyl-2-oxovalerate

HCID 4137900CAS 4502-00-5
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CC(C)CC(=O)C(=O)[O-].[Na+]
InChIKey
IXFAZKRLPPMQEO-UHFFFAOYSA-M
분자식
C6H9NaO3
평균 분자량
152.12 g/mol
단동위원소 질량
152.04493843

이름 및 식별자

우선 이름
Sodium 4-methyl-2-oxovalerate
IUPAC
sodium 4-methyl-2-oxopentanoate
현지명
케토이소카프로에이트나트륨
영어명
Sodium ketoisocaproate
분자식
C6H9NaO3
분자량
152.12

이름 및 동의어

4502-00-5sodium 4-methyl-2-oxopentanoateSodium 4-methyl-2-oxovalerateUNII-815X976CPY815X976CPYEINECS 224-816-3DTXSID70196363PENTANOIC ACID, 4-METHYL-2-OXO-, SODIUM SALT (1:1)RefChem:183723DTXCID80118854224-816-3Sodium alpha-ketoisocaproate
이름 더 보기
케토이소카프로에이트나트륨Ketoleucine sodiumSodium ketoisocaproatSodiuM α-oxoisocaproateSodium α-ketoisocaproateSODIUM ALPHA-KETOISOCAPRATE
Sodium ketoisocaproateKetoleucine sodium salt4-Methyl-2-oxovaleric acid sodium salt4-Methyl-2-oxopentanoic acid sodium saltSodium 2-KetoisocaproateSodium |A-Ketoisocaproatesodium;4-methyl-2-oxopentanoate2-Ketoisocaproic Acid Sodium Salt

데이터베이스 식별자

CAS
4502-00-5
PubChem CID
4137900
DTXSID
DTXSID70196363
ChEMBL
CHEMBL2142054
UNII
815X976CPY
EC Number
224-816-3
Nikkaji
J205.882K

물성

구조 계산 물성

극성 표면적
57.2 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
3
무거운 원자 수
10

실험 및 물리화학적 성질

Solubility · 2건

Soluble in water

Soluble (in ethanol)

Physical DescriptionWhite powder; slight fruity aroma

물리화학적 성질

녹는점
275 °C · 275 °C (dec.)(lit.)
저장 조건
2 · 2-8°C
용해도
물(약간 용해됨)
물리적 상태
고체
색상
흰색에서 황백색까지
냄새
100 %에서 · 100.00%에서. 부티르산 발레릭 버터리

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.

Warning

H319 (50%): 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 1 of 2 reports by companies.；There is 1 notification provided by 1 of 2 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 InformationPentanoic acid, 4-methyl-2-oxo-, sodium salt: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesEye Irrit. 2 (50%)

규제 정보

Regulatory InformationPentanoic acid, 4-methyl-2-oxo-, sodium salt: Does not have an individual approval but may be used under an appropriate group standard

안전 데이터

wgk
3
safety_code
24/25-22
Hazard Classifications
Eye Irrit. 2
스토리지 클래스
11 - Combustible Solids

화학 및 산업

용도 및 제조

Use Classification · 2건

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

응용 분야 · 2건

출처Reported found in banana, asparagus, cheese, white wine, cocoa, blue cheese and provolone cheese.

용도4-Methyl-2-oxovaleric Acid is an α-ketomonocarboxylic acid that triggers insulin release by acting upon receptor sites which differ from those occupied by amino acids. 4-Methyl-2-oxovaleric Acid is an intermediate in the metabolism of Leucine.

상·하류 제품 정보

하류 제품

공급사50 곳

阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
苏州道澜生物医药科技有限公司15952404857 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
南通飞宇生物科技有限公司0513-68819626 15152877458 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

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