4-메틸-2-페닐-1,3-티아졸-5-카르복실산

4-Methyl-2-phenyl-thiazole-5-carboxylic acid

HCID 720957CAS 33763-20-1
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
Cc1nc(-c2ccccc2)sc1C(=O)O
InChIKey
CRSMRBYEBHOYRM-UHFFFAOYSA-N
분자식
C11H9NO2S
평균 분자량
219.26 g/mol
단동위원소 질량
219.03539953

이름 및 식별자

우선 이름
4-Methyl-2-phenyl-thiazole-5-carboxylic acid
IUPAC
4-methyl-2-phenyl-1,3-thiazole-5-carboxylic acid
현지명
4-메틸-2-페닐-1,3-티아졸-5-카르복실산
영어명
4-METHYL-2-PHENYL-1,3-THIAZOLE-5-CARBOXYLIC ACID
분자식
C11H9NO2S
분자량
219.26

이름 및 동의어

4-Methyl-2-phenyl-thiazole-5-carboxylic acidRefChem:525155692-250-833763-20-14-methyl-2-phenyl-1,3-thiazole-5-carboxylic acid4-Methyl-2-phenylthiazole-5-carboxylic acid5-thiazolecarboxylic acid, 4-methyl-2-phenyl-MFCD001419554-methyl-2-phenyl-5-thiazolecarboxylic acid2-phenyl-4-methylthiazole-5-carboxylic acid5-Carboxy-2-phenylthiazoleMLS000716165
이름 더 보기
4-메틸-2-페닐-1,3-티아졸-5-카르복실산AKOS BBS-00004452IFLAB-BB F1912-00274-methyl-2-phenyl-5-thiazolecarboxylate4-Methyl-2-phenyl-5-thiazolecarboxylicacid2-Phenyl-4-methyl-5-thiazolecarboxylic acid4-Methyl-2-phenylthiazole-5-carboxylicacid,97%
orb3030815SCHEMBL1327631CHEMBL1374129HMS566O09DTXSID70352189CRSMRBYEBHOYRM-UHFFFAOYSA-NHMS2644L21Fr13329

데이터베이스 식별자

CAS
33763-20-1
PubChem CID
720957
DTXSID
DTXSID70352189
ChEMBL
CHEMBL1374129
EC Number
692-250-8
Nikkaji
J2.839.202H

물성

구조 계산 물성

XLogP
2.9
극성 표면적
78.4 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
4
회전 가능 결합 수
2
무거운 원자 수
15

물리화학적 성질

녹는점
210 · 210-212°C
끓는 점
424 · 424.0±37.0 °C(Predicted)
밀도
1.319 · 1.319±0.06 g/cm3(Predicted)
저장 조건
2 · 2-8°C
산도 계수 (pKa)
1.2 · 1.20±0.37(Predicted)

화학적 성질

White solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H302+H312+H332 (100%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 데이터

HS 번호
29349990
risk_code
36/37/38
hazard_code
Xi
safety_code
22-26-36/37/39
위험 등급
IRRITANT

화학 및 산업

상·하류 제품 정보

공급사50 곳

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Hunan Jibang Biological Technology Co., LTD13776644403 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
西安美科生物科技有限公司029-18710438009 18710438009 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

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