Salcomine

HCID 26517CAS 14167-18-1

기본 정보

표준 SMILES: [Co+2].[O-]c1ccccc1C=NCCN=Cc1ccccc1[O-]
InChIKey: NPAQSKHBTMUERN-UHFFFAOYSA-L
분자식: C16H14CoN2O2
평균 분자량: 325.23 g/mol
단동위원소 질량: 325.038721

이름 및 식별자

우선 이름: Salcomine
IUPAC: cobalt(2+);2-[2-[(2-oxidophenyl)methylideneamino]ethyliminomethyl]phenolate
영어명: SALCOMINE
분자식: C16H14CoN2O2
분자량: 325.23

이름 및 동의어

14167-18-1SALCOMINESalcomincobalt(2+);2-[2-[(2-oxidophenyl)methylideneamino]ethyliminomethyl]phenolateMFCD00000009Salicylaldehyde ethylenediimine cobalt(N,N'-Bis(salicylidene)ethylenediamine)cobalt(II)Bis(salicylaldehyde)ethylenediimine cobalt(II)(N,N'-Ethylenebis(salicylaldehyde iminato))cobalt(II)(Ethylenebis(nitrilomethylidyne)-2,2'-diphenolato)cobalt(II)Cobalt, N,N'-ethylenebis(salicylideneiminato)-N,N-Ethylenebis(salicylideneiminato)cobalt(II)

이름 더 보기

Co(salen)SALEN-COCO(SALEN)2Cobalt salen[N,N'-Bis(salicylidene)ethane-1,2-diaminato]cobalt(II)o’)-o(sp-4-2)-

N,N'-Bis(salicylidene)ethylenediiminocobalt(II)N2O9115YTKNSC32965NSC-32965C16H14CoN2O2N,N'-Bis(salicylidene)ethylenediaminocobalt(II)SALCOMINE [HSDB]SCHEMBL510827

데이터베이스 식별자

CAS: 14167-18-1
PubChem CID: 26517
UNII: N2O9115YTK

물성

구조 계산 물성

극성 표면적: 70.8 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 5
무거운 원자 수: 21
형식 전하: 0
복잡도: 298

물리화학적 성질

녹는점: 300 °C · >300 °C
저장 조건: Inert atmosphere,Room Temperature
물리적 상태: 가루
색상: Orange to Amber to Dark red
수용성: 물에 불용성. 벤젠, 에 용해됨클로로포름, 피리딘에 용해됩니다.
안정성: 안정적인. 강산, 강산화제와 호환되지 않습니다.
InChI: InChI=1S/C16H16N2O2.Co/c19-15-7-3-1-5-13(15)11-17-9-10-18-12-14-6-2-4-8-16(14)20;/h1-8,11-12,19-20H,9-10H2;/q;+2/p-2/b17-11+,18-12+;
InChIKey: NPAQSKHBTMUERN-OYJDLGDISA-L
SMILES: C12=CC=CC=C1C=NCCN=CC1=CC=CC=C1O[Co]O2 |t:7,11|
EPA: Salcomine (14167-18-1)

화학적 성질

black crystalline powder

안전 및 규제

안전 데이터

wgk: 2
tsca: TSCA listed
rtecs: GG0590000
독성: mouse,LCLo,inhalation,390mg/m3/5.5H (390mg/m3),LUNGS, THORAX, OR RESPIRATION: STRUCTURAL OR FUNCTIONAL CHANGE IN TRACHEA OR BRONCHILUNGS, THORAX, OR RESPIRATION: OTHER CHANGESLUNGS, THORAX, OR RESPIRATION: CHRONIC PULMONARY EDEMA,Aerospace Medical Research Laboratory Report. Vol. TR-74-78, Pg. 1974,
HS 번호: 29349990
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
F 고인화성물질: 10
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스: 11 - Combustible Solids
유해 물질 데이터: 14167-18-1(Hazardous Substances Data)

화학 및 산업

응용 분야 · 2건

용도Salcomine catalyzes the oxidation of 2,6-disubstituted phenols by dioxygen. Experimental inhibitor of human cytμloviris proteinase activity. Metal complex dyes used as redox catalysts.

일반 설명A solid complex between the cobalt(II) ion and the condensation product of salicylaldehyde and ethylenediamine. Such condensation products are called "Schiff's bases." Complexation with cobalt nullifies their basic properties. Used as a catalyst for various oxidation reactions in which SALCOMINE behaves as an oxygen carrier.