2-카르베톡시-3-(2-티에닐)프로판산

Ethyl 2-carboxy-3-(2-thienyl)propionate

HCID 14952883
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기본 정보

CAS
143468-96-6
표준 SMILES
CCOC(=O)C(Cc1cccs1)C(=O)O
InChIKey
PMJNEQWWZRSFCE-UHFFFAOYSA-N
분자식
C10H12O4S
평균 분자량
228.27 g/mol
단동위원소 질량
228.04563003

이름 및 식별자

우선 이름
Ethyl 2-carboxy-3-(2-thienyl)propionate
IUPAC
3-ethoxy-3-oxo-2-(thiophen-2-ylmethyl)propanoic acid
현지명
2-카르베톡시-3-(2-티에닐)프로판산
영어명
2-Carbethoxy-3-(2-thienyl)propanoic acid
분자식
C10H12O4S
분자량
228.26

이름 및 동의어

143468-96-6Ethyl 2-carboxy-3-(2-thienyl)propionateEC 415-680-8RefChem:594270415-680-82-Carbethoxy-3-(2-thienyl)propionic acid3-ethoxy-3-oxo-2-(thiophen-2-ylmethyl)propanoic acid2-Carbethoxy-3-(2-thienyl)propanoic acid2-(2-Thienylmethyl)propanedioic Acid 1-Ethyl Ester3-Ethoxy-3-oxo-2-[(thiophen-2-yl)methyl]propanoic acid(2-Thienylmethyl)propanedioic acid monoethyl ester2-(Ethoxycarbonyl)-3-(thien-2-yl)propanoic acid
이름 더 보기
2-카르베톡시-3-(2-티에닐)프로판산2-Carbethoxy-3-(3-thienyl)propionic acid2-Carbethoxy-3-(2-Thienyl)-Propionic Acid2-(thiophen-2-ylmethyl)-malonic acid 1-ethyl ester2-CARBETHOXY-3-(2-THIENYL)PROPANOIC ACID 143468-96-6
3-ethoxy-3-oxo-2-(2-thienylmethyl)propanoic acidSCHEMBL934056DTXSID30565990MFCD01862198AKOS015897659AC-87362-Carbethoxy-3-(2-thienyl)propionicacidBS-52962

데이터베이스 식별자

CAS
143468-96-6
PubChem CID
14952883
DTXSID
DTXSID30565990
EC Number
415-680-8
Nikkaji
J1.220.432I

물성

구조 계산 물성

XLogP
1.9
극성 표면적
91.8 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
5
회전 가능 결합 수
6
무거운 원자 수
15

물리화학적 성질

끓는 점
170 °C · 170 °C(Press: 12.2 Torr)
밀도
1.295 · 1.295
저장 조건
2 · 2-8°C(protect from light)
산도 계수 (pKa)
2.67 · 2.67±0.34(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 6건

Danger

H315: Causes skin irritation [Warning Skin corrosion/irritation]；H317: May cause an allergic skin reaction [Warning Sensitization, Skin]；H318: Causes serious eye damage [Danger Serious eye damage/eye irritation]

P261, P264, P264+P265, P272, P280, P302+P352, P305+P354+P338, P317, P321, P332+P317, P333+P317, P362+P364, and P501 (click each P-code to see the statement)

Danger

유해성 정보

Regulatory InformationStatus: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/4402
Hazard Classes and Categories · 3건

Skin Irrit. 2 (100%)；Skin Sens. 1 (100%)；Eye Dam. 1 (100%)

Skin irritation - category 2；Eye damage - category 1；Skin sensitisation - category 1

Skin Irrit. 2；Eye Dam. 1；Skin Sens. 1

규제 정보

Regulatory InformationStatus: Active Update: 10-11-2008 https://echa.europa.eu/registration-dossier/-/registered-dossier/4402

안전 데이터

risk_code
38-41-43
hazard_code
Xi
safety_code
24-26-37/39

화학 및 산업

응용 분야

용도2-Carbethoxy-3-(2-thienyl)propanoic acid is used in the preparatiom of angiotensin II receptor antagonists.

상·하류 제품 정보

하류 제품

공급사41 곳

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]

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