1H-Pyrrole-2,5-dione, 1,1'-(2,2,4-trimethyl-1,6-hexanediyl)bis-

HCID 170261CAS 39979-46-9

기본 정보

표준 SMILES: CC(CCN1C(=O)C=CC1=O)CC(C)(C)CN1C(=O)C=CC1=O
InChIKey: XQCDLHVXAXBMGW-UHFFFAOYSA-N
분자식: C17H22N2O4
평균 분자량: 318.4 g/mol
단동위원소 질량: 318.15795719

이름 및 식별자

우선 이름: 1H-Pyrrole-2,5-dione, 1,1'-(2,2,4-trimethyl-1,6-hexanediyl)bis-
IUPAC: 1-[6-(2,5-dioxopyrrol-1-yl)-3,5,5-trimethylhexyl]pyrrole-2,5-dione
영어명: 1,1'-(2,2,4-trimethylhexane-1,6-diyl)bis-1H-pyrrole-2,5-dione
분자식: C17H22N2O4
분자량: 318.37

이름 및 동의어

39979-46-91H-Pyrrole-2,5-dione, 1,1'-(2,2,4-trimethyl-1,6-hexanediyl)bis-EINECS 254-730-11,1'-(2,2,4-Trimethylhexane-1,6-diyl)bis-1H-pyrrole-2,5-dioneDTXSID20885790RefChem:439186DTXCID601025152254-730-11-[6-(2,5-dioxopyrrol-1-yl)-3,5,5-trimethylhexyl]pyrrole-2,5-dione1H-Pyrrole-2,5-dione,1,1'-(2,2,4-trimethyl-1,6-hexanediyl)bis-1,1'-(2,2,4-trimethylhexane-1,6-diyl)bis(1h-pyrrole-2,5-dione)SCHEMBL258452

이름 더 보기

2,2,4-TrimethylhexamethylenebismaleimideN,N'-(2,2,4-Trimethylhexane-1,6-diyl)dimaleimideN,N'-(2,2,4-Trimethylhexane-1,6-diyl)bis(maleimide)N,N'-(2,2,4-Trimethyl-1,6-hexanediyl)bis(maleimide)1,1'-(2,2,4-Trimethyl-1,6-hexanediyl)bis(1H-pyrrole-2,5-dione)5-dione, 1,1'-(2,2,4-trimethyl-1,6-hexanediyl)bis-1H-Pyrrole-2 1,1'-(2,2,4-trimethyl-1,6-hexanediyl)bis-1h-pyrrole-5-dione 1,1'-(2,2,4-trimethyl-1,6-hexanediyl)bis-1h-pyrrole-5-dione 1H-Pyrrole-2,5-dione,1,1'-(2,2,4-trimethyl-1,6-hexanediyl)bis-

1,6-bismaleimido-2,2,4-trimethylhexane1,6-bismaleimido(2,2,4-trimethyl)hexaneNS000574281,1'-(2,2,4-Trimethylhexane-1,6-diyl)di(1H-pyrrole-2,5-dione)

데이터베이스 식별자

CAS: 39979-46-9
PubChem CID: 170261
DTXSID: DTXSID20885790
EC Number: 254-730-1
Nikkaji: J261.492H

물성

구조 계산 물성

XLogP: 1.4
극성 표면적: 74.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 7
무거운 원자 수: 23
형식 전하: 0
복잡도: 568

물리화학적 성질

녹는점: 95 °C · 95°C
끓는 점: 476.5 · 476.5±28.0 °C(Predicted)
밀도: 1.216 · 1.216±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C
물리적 상태: powder or crystals
산도 계수 (pKa): -2.2 · -2.20±0.20(Predicted)
색상: white to yellow
InChI: 1S/C17H22N2O4/c1-12(8-9-18-13(20)4-5-14(18)21)10-17(2,3)11-19-15(22)6-7-16(19)23/h4-7,12H,8-11H2,1-3H3
InChIKey: XQCDLHVXAXBMGW-UHFFFAOYSA-N
SMILES: O=C1C=CC(=O)N1CCC(C)CC(C)(C)CN2C(=O)C=CC2=O
EPA: 1 H-Pyrrole-2,5-dione, · 1H-Pyrrole-2,5-dione, 1,1'-(2,2,4-trimethyl-1,6-hexanediyl)bis- (39979-46-9)

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (93.3%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (93.3%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P261, P264, P264+P265, P272, P280, P302+P352, P305+P351+P338, P321, P332+P317, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 15 reports by companies from 2 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.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (93.3%)；Skin Sens. 1 (93.3%)；Eye Irrit. 2 (100%)

안전 데이터

wgk: WGK 3
tsca: TSCA listed
스토리지 클래스: 11 - Combustible Solids

화학 및 산업

용도 및 제조

General Manufacturing Information1H-Pyrrole-2,5-dione, 1,1'-(2,2,4-trimethyl-1,6-hexanediyl)bis-: ACTIVE

공급사7 곳

郑州阿尔法化工有限公司+86-18530059196 · [email protected]

陕西格列弗生物科技研究有限责任公司13892423764 · [email protected]

郑州九亿时光新材料有限公司+86-15225627621 +86-13213167925 · [email protected]

Alfa Chemistry+1-5166625404 · [email protected]

常州北山化工有限公司+86-021-61559630 +86-13761092941 · [email protected]

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