4-하이드록시메틸티아졸

(1,3-Thiazol-4-yl)methanol

HCID 2763215

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 7036-04-6
표준 SMILES: OCc1cscn1
InChIKey: WQVOUANKVCYEIQ-UHFFFAOYSA-N
분자식: C4H5NOS
평균 분자량: 115.16 g/mol
단동위원소 질량: 115.00918496

이름 및 식별자

우선 이름: (1,3-Thiazol-4-yl)methanol
IUPAC: 1,3-thiazol-4-ylmethanol
현지명: 4-하이드록시메틸티아졸
영어명: 4-Hydroxymethylthiazole
분자식: C4H5NOS
분자량: 115.15

이름 및 동의어

(1,3-thiazol-4-yl)methanolRefChem:391418672-899-37036-04-64-(Hydroxymethyl)thiazole4-Hydroxymethylthiazolethiazole-4-methanolthiazol-4-ylmethanol1,3-thiazol-4-ylmethanolMFCD041157284-(hydroxymethyl)-1,3-thiazole4-THIAZOLEMETHANOL

이름 더 보기

4-하이드록시메틸티아졸4-(Hydroxymethyl)-1,3-thiazole95%4-(Hydroxymethyl)-1,3-thiazole 95%4-HydroxyMethylthiazole CAS7036-04-6

(Thiazol-4-yl)methanol4-Hydroxymethylthiaz(4-thiazolyl)methanolthiazol-4-yl-methanolSCHEMBL243565SCHEMBL243566SCHEMBL9709051,3-thiazol-4-ylmethan-1-ol

데이터베이스 식별자

CAS: 7036-04-6
PubChem CID: 2763215
DTXSID: DTXSID80376816
EC Number: 672-899-3
Nikkaji: J2.226.429J

물성

구조 계산 물성

XLogP: 0.1
극성 표면적: 61.4 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 7
형식 전하: 0
복잡도: 59

물리화학적 성질

녹는점: 112 · 112-114 °C(Solv: ethyl ether (60-29-7); ethanol (64-17-5))
끓는 점: 85 · 85-90/0.5mm
밀도: 1.339 · 1.339±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C
물리적 상태: 액체
산도 계수 (pKa): 13.21 · 13.21±0.10(Predicted)
색상: 무색
InChI: InChI=1S/C4H5NOS/c6-1-4-2-7-3-5-4/h2-3,6H,1H2
InChIKey: WQVOUANKVCYEIQ-UHFFFAOYSA-N
SMILES: S1C=C(CO)N=C1

화학적 성질

Off-yellow oily liquid

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): 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 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)

안전 데이터

HS 번호: 2934100090
risk_code: 37/38-41
hazard_code: Xi
safety_code: 26-39
위험 참고 사항: Irritant

화학 및 산업

응용 분야

용도4-Hydroxymethylthiazole is mainly used as a pharmaceutical intermediate.

상·하류 제품 정보

상류 원료

4-티아졸메탄올,아세테이트(에스테르)(9CI)4-티아졸 카르복실산 Thiazole-4-carboxaldehyde Ethyl thiazole-4-carboxylate 메틸티아졸(4-)수소화 리튬알미늄 초산에틸 수산화나트륨 테트라하이드로푸란

공급사88 곳

南京波普生物医药研发有限公司025-87138562 18951783565 · [email protected]

韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

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]

화합물 노트

불러오는 중…