N-(4-아미노-2-메틸페닐)-4-클로로프탈이미드

N-(4-Amino-o-tolyl)-4-chlorophthalimide

HCID 93991CAS 58230-69-6

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Cc1cc(N)ccc1N1C(=O)c2ccc(Cl)cc2C1=O
InChIKey: LIVAQMJLPOCEMO-UHFFFAOYSA-N
분자식: C15H11ClN2O2
평균 분자량: 286.71 g/mol
단동위원소 질량: 286.05090527

이름 및 식별자

우선 이름: N-(4-Amino-o-tolyl)-4-chlorophthalimide
IUPAC: 2-(4-amino-2-methylphenyl)-5-chloroisoindole-1,3-dione
현지명: N-(4-아미노-2-메틸페닐)-4-클로로프탈이미드
영어명: N-(4-AMINO-2-METHYLPHENYL)-4-CHLOROPHTHALIMIDE
분자식: C15H11ClN2O2
분자량: 286.71

이름 및 동의어

58230-69-6N-(4-Amino-o-tolyl)-4-chlorophthalimideEINECS 261-173-8DTXSID202069662-(4-Amino-2-methylphenyl)-5-chloro-1H-isoindole-1,3(2H)-dioneRefChem:827109DTXCID50129457261-173-8N-(4-Amino-2-methylphenyl)-4-chlorophthalimide2-(4-Amino-2-methylphenyl)-5-chloroisoindoline-1,3-dione2-(4-amino-2-methylphenyl)-5-chloroisoindole-1,3-dioneMFCD00005892

이름 더 보기

N-(4-아미노-2-메틸페닐)-4-클로로프탈이미드AKOS BBS-00007963TIMTEC-BB SBB001168OTAVA-BB BB01251602432-(4-Amino-2-methylphenyl)-5-chloro-1,3-isoindolinedione2-(2-Methyl-4-aminophenyl)-5-chloro-2H-isoindole-1,3-dione

N-[4-Amino-2-methylphenyl]-4-chlorophthalimide2-(4-amino-2-methylphenyl)-5-chlorobenzo[c]azoline-1,3-dioneOprea1_160116SCHEMBL1548403LIVAQMJLPOCEMO-UHFFFAOYSA-SBB0011682-(4-amino-2-methylphenyl)-5-chloro-2,3-dihydro-1H-isoindole-1,3-dioneAKOS000274102

데이터베이스 식별자

CAS: 58230-69-6
PubChem CID: 93991
DTXSID: DTXSID20206966
EC Number: 261-173-8
Nikkaji: J236.513H

물성

구조 계산 물성

XLogP: 2.8
극성 표면적: 63.4 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 20
형식 전하: 0
복잡도: 428

물리화학적 성질

녹는점: 208 · 208-210 °C(lit.)
끓는 점: 519 · 519.0±60.0 °C(Predicted)
밀도: 1.453 · 1.453±0.06 g/cm3(Predicted)
산도 계수 (pKa): 4.85 · 4.85±0.10(Predicted)

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.