5-Fluoro-6-nitro-2,3-dihydro-1,3-benzoxazol-2-one

HCID 11217835CAS 132667-24-4

기본 정보

표준 SMILES: O=c1[nH]c2cc(F)c([N+](=O)[O-])cc2o1
InChIKey: OYLSATYIXHNQKT-UHFFFAOYSA-N
분자식: C7H3FN2O4
평균 분자량: 198.11 g/mol
단동위원소 질량: 198.00768474

이름 및 식별자

우선 이름: 5-Fluoro-6-nitro-2,3-dihydro-1,3-benzoxazol-2-one
IUPAC: 5-fluoro-6-nitro-3H-1,3-benzoxazol-2-one

이름 및 동의어

5-fluoro-6-nitro-2,3-dihydro-1,3-benzoxazol-2-one132667-24-4RefChem:535937995-636-75-FLUORO-6-NITRO-3H-1,3-BENZOXAZOL-2-ONE5-fluoro-6-nitro-2(3H)-benzoxazoloneSCHEMBL69709275-fluoro-6-nitro-benzooxazolinoneOYLSATYIXHNQKT-UHFFFAOYSA-N5-fluoro-6-nitro-benzoxazol-2-oneHFA667245-Fluoro-6-nitrobenzoxazolin-2-one

이름 더 보기

AKOS026730115EN300-115158G59587

데이터베이스 식별자

CAS: 132667-24-4
PubChem CID: 11217835
EC Number: 995-636-7

물성

구조 계산 물성

XLogP: 1.1
극성 표면적: 84.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 5
회전 가능 결합 수: 0
무거운 원자 수: 14
형식 전하: 0
복잡도: 279

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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.