2-Methoxy-4-(2-nitroethenyl)-1-(phenylmethoxy)benzene

HCID 15828CAS 1860-56-6

기본 정보

표준 SMILES: COc1cc(C=C[N+](=O)[O-])ccc1OCc1ccccc1
InChIKey: YDGNRJKNDGBMCL-UHFFFAOYSA-N
분자식: C16H15NO4
평균 분자량: 285.29 g/mol
단동위원소 질량: 285.10010796

이름 및 식별자

우선 이름: 2-Methoxy-4-(2-nitroethenyl)-1-(phenylmethoxy)benzene
IUPAC: 2-methoxy-4-(2-nitroethenyl)-1-phenylmethoxybenzene

이름 및 동의어

2-Methoxy-4-(2-nitroethenyl)-1-(phenylmethoxy)benzeneRefChem:2625471860-56-64-Benzyloxy-3-methoxy-beta-nitrostyrene4-benzyloxy-3-methoxynitrostyreneOprea1_8577232-methoxy-4-(2-nitroethenyl)-1-phenylmethoxybenzeneSCHEMBL51858132-methoxy-4-[(Z)-2-nitroethenyl]-1-phenylmethoxy-benzeneYDGNRJKNDGBMCL-UHFFFAOYSA-NDTXSID101214201AKOS030239771

이름 더 보기

4-(benzyloxy)-3-methoxy--nitrostyreneDB-054575DB-2530851-benzyloxy-2-methoxy-4-(2-nitrovinyl)benzene1-(benzyloxy)-2-methoxy-4-(2-nitroethenyl)benzene

데이터베이스 식별자

CAS: 1860-56-6
PubChem CID: 15828
DTXSID: DTXSID101214201
EC Number: 631-591-9

물성

구조 계산 물성

XLogP: 3.4
극성 표면적: 64.3 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 5
무거운 원자 수: 21
형식 전하: 0
복잡도: 347

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/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 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.