에틸(R)-2-하이드록시-4-페닐부티레이트

Ethyl (R)-2-hydroxy-4-phenylbutyrate

HCID 2733848CAS 90315-82-5
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CCOC(=O)[C@H](O)CCc1ccccc1
InChIKey
ZJYKSSGYDPNKQS-LLVKDONJSA-N
분자식
C12H16O3
평균 분자량
208.25 g/mol
단동위원소 질량
208.10994437

이름 및 식별자

우선 이름
Ethyl (R)-2-hydroxy-4-phenylbutyrate
IUPAC
ethyl (2R)-2-hydroxy-4-phenylbutanoate
현지명
에틸(R)-2-하이드록시-4-페닐부티레이트
영어명
Ethyl (R)-2-hydroxy-4-phenylbutyrate
분자식
C12H16O3
분자량
208.26

이름 및 동의어

90315-82-5Ethyl (R)-2-Hydroxy-4-phenylbutyrateQP7IWH2QOXEthyl 2-hydroxy-4-phenylbutyrate, (2R)-(R)-HPBERefChem:593165618-525-4ethyl (2R)-2-hydroxy-4-phenylbutanoate(R)-ethyl 2-hydroxy-4-phenylbutanoateethyl (R)-2-hydroxy-4-phenylbutanoate(R)-2-Hydroxy-4-phenylbutyric Acid Ethyl EsterMFCD00077794
이름 더 보기
에틸(R)-2-하이드록시-4-페닐부티레이트(R)-2-HYDROXY-4-PHENYLBUTYRATERBZLEEthyl (R)-2-hydroxy-Benazepril Impurity 22Nitroxoline Impurity 13R-2-Hydroxy-4-butylphenyacetateEthyl 4-phenyl-2-hydroxybutanoateEthy(R)-2-hydroxy-4-phenybutyrateEthyl(R)-2-Hydroxyl-4-PhenylButyrate
Ethyl (R)-(-)-2-hydroxy-4-phenylbutyrateUNII-QP7IWH2QOXSCHEMBL614649DTXSID20370015EC 618-525-4(R)-(-)-2-Hydroxy-4-phenylbutyric acid ethyl estherCS-W015213ethyl (R)-2-hydrox

데이터베이스 식별자

CAS
90315-82-5
PubChem CID
2733848
DTXSID
DTXSID20370015
ChEMBL
CHEMBL4630646
UNII
QP7IWH2QOX
EC Number
618-525-4
Nikkaji
J275.578E

물성

구조 계산 물성

XLogP
2.2
극성 표면적
46.5 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
3
회전 가능 결합 수
6
무거운 원자 수
15

물리화학적 성질

녹는점
NA
끓는 점
212 °C · 212 °C(lit.)
밀도
1.075 g/mL · 1.075 g/mL at 20 °C(lit.)
굴절률
20 · n20/D 1.504(lit.)
인화점
230 °F · >230 °F
저장 조건
-20 °C · Sealed in dry,Store in freezer, under -20°C

화학적 성질

Colorless to light yellow liqui

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 80% (4 of 5) of all reports.

Warning

H315 (20%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (20%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (20%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 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 4 of 5 reports by companies.；There is 1 notification provided by 1 of 5 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 InformationStatus: Active Update: 09-02-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/6749
Hazard Classes and CategoriesSkin Irrit. 2 (20%)；Eye Irrit. 2 (20%)；STOT SE 3 (20%)

규제 정보

Regulatory InformationStatus: Active Update: 09-02-2012 https://echa.europa.eu/registration-dossier/-/registered-dossier/6749

안전 데이터

wgk
3
HS 번호
29181990
safety_code
23-24/25
스토리지 클래스
10 - Combustible liquids

화학 및 산업

응용 분야

용도Ethyl(R)-2-hydroxy-4-phenylbutyrate is used in the preparation of benzothiophenes, benzofurans, and indoles useful in the treatment of insulin resistance and hyperglycemia.

상·하류 제품 정보

공급사50 곳

北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

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