N-ethylisatoic anhydride

HCID 3249856CAS 50332-68-8

기본 정보

표준 SMILES: CCn1c(=O)oc(=O)c2ccccc21
InChIKey: UHCPCZKBZOSOLC-UHFFFAOYSA-N
분자식: C10H9NO3
평균 분자량: 191.18 g/mol
단동위원소 질량: 191.05824315

이름 및 식별자

우선 이름: N-ethylisatoic anhydride
IUPAC: 1-ethyl-3,1-benzoxazine-2,4-dione

이름 및 동의어

N-ethylisatoic anhydride50332-68-8DTXSID10390641RefChem:163353DTXCID60341502664-947-71-ethyl-3,1-benzoxazine-2,4-dione1-ethyl-2,4-dihydro-1H-3,1-benzoxazine-2,4-dioneN-ethyl isatoic anhydride1-Ethyl-1H-benzo[d][1,3]oxazine-2,4-dioneSCHEMBL6305077CHEMBL2146655

이름 더 보기

UHCPCZKBZOSOLC-UHFFFAOYSA-NAKOS0026650331-Ethyl-2H-3,1-benzoxazine-2,4(1H)-dione1-Ethyl-2H-benzo[d][1,3]oxazine-2,4(1H)-dione

데이터베이스 식별자

CAS: 50332-68-8
PubChem CID: 3249856
DTXSID: DTXSID10390641
ChEMBL: CHEMBL2146655
EC Number: 664-947-7
Nikkaji: J2.925.621G

물성

구조 계산 물성

XLogP: 1.6
극성 표면적: 46.6 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 14
형식 전하: 0
복잡도: 264

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 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.