N-에틸프탈이미드

N-Ethylphthalimide

HCID 21120CAS 5022-29-7

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CCN1C(=O)c2ccccc2C1=O
InChIKey: JZDSOQSUCWVBMV-UHFFFAOYSA-N
분자식: C10H9NO2
평균 분자량: 175.18 g/mol
단동위원소 질량: 175.06332853

이름 및 식별자

우선 이름: N-Ethylphthalimide
IUPAC: 2-ethylisoindole-1,3-dione
현지명: N-에틸프탈이미드
영어명: N-Ethylphthalimide
분자식: C10H9NO2
분자량: 175.18

이름 및 동의어

N-Ethylphthalimide2-ethylisoindoline-1,3-dionePHTHALIMIDE, N-ETHYL-1H-Isoindole-1,3(2H)-dione, 2-ethyl-2-Ethyl-1H-isoindole-1,3(2H)-dione1H-Isoindole-1,3(2H)-dione, N-ethyl-NSC 2774EINECS 225-707-3BRN 01320942PU4A53CO7AI3-01394NSC-2774

이름 더 보기

N-에틸프탈이미드n-ethyl-phthalimidSPECS AG-455/02685023N-Ethylphthalimide,98%N-ethylphthalazineisoamine2-Ethyl-2H-isoindole-1,3-dioneDimethyl 39-bromo terephthalate2-ethyl-1h-isoindole-3(2h)-dione

UNII-2PU4A53CO71H-Iosindole-1,3(2H)-dione, 2-ethyl-DTXSID40521345-21-10-00274 (Beilstein Handbook Reference)RefChem:163365DTXCID90307031H-Iosindole-1,3(2H)-dione, 2-ethyl-(9CI)1H-Isoindole-1,3(2H)-dione, N-ethyl-(9CI)

데이터베이스 식별자

CAS: 5022-29-7
PubChem CID: 21120
DTXSID: DTXSID4052134
UNII: 2PU4A53CO7
EC Number: 225-707-3
Nikkaji: J50.516A

물성

구조 계산 물성

XLogP: 1.9
극성 표면적: 37.4 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: 0
복잡도: 225

실험 및 물리화학적 성질

Collision Cross Section133.7 Å² [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID4052134]

물리화학적 성질

녹는점: 73 · 73-77 °C
끓는 점: 285 ℃ · 285℃
밀도: 1.249 · 1.249
굴절률: 1.546 · 1.5460 (estimate)
인화점: 122 ℃ · 122℃
저장 조건: 2 · Storage temp. 2-8°C
산도 계수 (pKa): -2.09 · -2.09±0.20(Predicted)
BRN: 132094 · 132094
EPA: 1 H-Isoindole-1,3 · 1H-Isoindole-1,3(2H)-dione, 2-ethyl- (5022-29-7)

화학적 성질

white crystalline powder

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 44 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Chemical: 1H-Isoindole-1,3(2H)-dione, 2-ethyl-

1H-Isoindole-1,3(2H)-dione, 2-ethyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesSkin Irrit. 2 (100%)