5-(4-Chlorophenyl)-1,2-oxazole-3-carbaldehyde

HCID 16217816CAS 763109-09-7

기본 정보

표준 SMILES: O=Cc1cc(-c2ccc(Cl)cc2)on1
InChIKey: TUGDVOPMQBYENX-UHFFFAOYSA-N
분자식: C10H6ClNO2
평균 분자량: 207.61 g/mol
단동위원소 질량: 207.00870611

이름 및 식별자

우선 이름: 5-(4-Chlorophenyl)-1,2-oxazole-3-carbaldehyde
IUPAC: 5-(4-chlorophenyl)-1,2-oxazole-3-carbaldehyde
영어명: 5-(4-Chlorophenyl)isoxazole-3-carboxald&
분자식: C10H6ClNO2
분자량: 207.61

이름 및 동의어

763109-09-75-(4-chlorophenyl)-1,2-oxazole-3-carbaldehydeDTXSID20584574RefChem:299854DTXCID70535339624-122-45-(4-Chlorophenyl)isoxazole-3-carboxaldehyde5-(4-chlorophenyl)isoxazole-3-carbaldehydeMFCD06199345SCHEMBL11902664SCHEMBL15362149TUGDVOPMQBYENX-UHFFFAOYSA-N

이름 더 보기

5-(4-chlorophenyl)isoazole-3-methylaldehyde3-Isoxazolecarboxaldehyde, 5-(4-chlorophenyl)-

AKOS017344767AS-87987SY120693CS-0255224G68280EN300-7360681F4939935-(4-Chlorophenyl)isoxazole-3-carboxaldehyde, 97%

데이터베이스 식별자

CAS: 763109-09-7
PubChem CID: 16217816
DTXSID: DTXSID20584574
EC Number: 624-122-4

물성

구조 계산 물성

XLogP: 3
극성 표면적: 43.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 2
무거운 원자 수: 14
형식 전하: 0
복잡도: 204

물리화학적 성질

녹는점: 136 · 136-140 °C (lit.)
물리적 상태: solid
InChI: 1S/C10H6ClNO2/c11-8-3-1-7(2-4-8)10-5-9(6-13)12-14-10/h1-6H
InChIKey: TUGDVOPMQBYENX-UHFFFAOYSA-N
SMILES: [H]C(=O)c1cc(on1)-c2ccc(Cl)cc2

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]

P233, P260, P261, P264, P264+P265, P270, P271, P272, P280, P284, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P342+P316, P362+P364, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (97.5%)

안전 데이터

wgk: 2
risk_code: 22-36/37/38-42/43
hazard_code: Xn
safety_code: 26-36-45
Hazard Classifications: Acute Tox. 4 OralEye Irrit. 2Resp. Sens. 1Skin Irrit. 2Skin Sens. 1STOT SE 3
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

공급사20 곳

安特希（苏州）生物科技有限公司19951207836

Syntechem Co.,Ltd[email protected]

安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]

上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]

上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]

연결된 노트

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