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Cobaltocene

HCID 92884
새 노트새 반응견적 요청하기
인쇄 미리보기
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
1277-43-6
표준 SMILES
[Co+2].c1cc[cH-]c1.c1cc[cH-]c1
InChIKey
ILZSSCVGGYJLOG-UHFFFAOYSA-N
분자식
C10H10Co
평균 분자량
189.12 g/mol
단동위원소 질량
189.011444

개요

Cobaltocene appears as black-purple crystals or black solid. Sublimes at 104 °F and 0.1 mmHg. (NTP, 1992)

이름 및 식별자

우선 이름
Cobaltocene
IUPAC
cobalt(2+);bis(cyclopenta-1,3-diene)
영어명
Bis(cyclopentadienyl)cobalt
분자식
C10H10Co10*
분자량
189.12

이름 및 동의어

Cobaltocene1277-43-6Bis(cyclopentadienyl)cobaltMFCD000137494W7LGU89CVCobalt, bis(eta5-2,4-cyclopentadien-1-yl)-DTXSID0024840Kobaltocen [Czech]C10H10CoNSC 62690CCRIS 6001Cobalt, di-pi-cyclopentadienyl-
이름 더 보기
BIS(CYCLOPENTADIENYL)COBALT(II)Bis(cyclopentadienyl)cobalt(II),min.98%(Cobaltocene)toceneKobaltocenCobaltocene,98%Ferrocene cobaltcobaltocene(1277-43-6)DicyclopentadienylcobaltBiscyclopentadienylcobal
EINECS 215-061-0UNII-4W7LGU89CVcobaltous;cyclopenta-1,3-dieneSCHEMBL236827DTXCID204840Tox21_202502NCGC00091934-01NCGC00260051-01

데이터베이스 식별자

CAS
1277-43-6
PubChem CID
92884
UNII
4W7LGU89CV
EC Number
215-061-0

물성

구조 계산 물성

극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
0
무거운 원자 수
11
형식 전하
0
복잡도
11.6

실험 및 물리화학적 성질

Chemical ClassesMetals -> Organic Compounds, Metal Salts
Solubilityless than 1 mg/mL at 70.7 °F (NTP, 1992)
Melting Point343 to 345 °F (NTP, 1992)
Physical Description · 2건

Cobaltocene appears as black-purple crystals or black solid. Sublimes at 104 °F and 0.1 mmHg. (NTP, 1992)

Black-purple or black solid; Insoluble in water; [CAMEO] Black-violet crystals; [Acros Organics MSDS]

물리화학적 성질

녹는점
176 · 176-180 °C (dec.)(lit.)
끓는 점
173 ℃ · 173℃ [CRC10]
저장 조건
2 · 2-8°C
물리적 상태
수정 같은
색상
자색-검정색
수용성
물에 불용성.
안정성
안정적이지만 반응성이 매우 높으며 공기와 습기에 민감합니다. 불활성 가스하에 보관하십시오. 강한 산화제와 호환되지 않습니다. 가연성이 높습니다.
InChI
InChI=1S/2C5H5.Co/c2*1-2-4-5-3-1;/h2*1-5H;
InChIKey
PXFGMRZPRDJDEK-UHFFFAOYSA-N
SMILES
[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Co] |^1:0,1,2,3,4,5,6,7,8,9|

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 4건

Danger

H228 (100%): Flammable solid [Danger Flammable solids]

P203, P210, P233, P240, P241, P260, P261, P271, P272, P280, P284, P302+P352, P304+P340, P318, P321, P333+P317, P342+P316, P362+P364, P370+P378, P403, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 149 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

DOT LabelFlammable Solid
Fire HazardsVendor information indicates that this chemical is flammable. (NTP, 1992)
Health HazardsACUTE/CHRONIC HAZARDS: This compound is toxic by ingestion. (NTP, 1992)
Hazards Summary · 1건

Intraperitoneal LD50 (mouse) = 80 mg/kg; [RTECS] A strong reducing agent; Readily oxidized by air and water; Sensitive to air and light exposure; [CAMEO] Highly reactive; Toxic by ingestion; [NTP] An irritant; Ingestion may cause CNS depression; [Acros Organics MSDS] See Cobalt.

Reactive GroupHydrocarbons, Aromatic
Reactivity AlertsHighly Flammable
Reactivity ProfileCOBALTOCENE is very sensitive to air and is readily oxidized. It is also sensitive to exposure to light. Readily oxidized by water and dilute acids (NTP, 1992).
Air and Water ReactionsAir-sensitive. Highly flammable. Insoluble in water.
Hazard Classes and Categories

화학 및 산업

약리 정보

Metabolism/Metabolites · 1건

Cobalt is absorbed though the lungs, gastrointestinal tract, and skin. Since it is a component of the vitamin B12 (cyanocobalamin), it is distributed to most tissues of the body. It is transported in the blood, often bound to albumin, with the highest levels being found in the liver and kidney. Cobalt is excreted mainly in the urine and faeces. (L29)

용도 및 제조

Uses · 2건

Used to catalyze synthesis of pyridines from alkynes and nitriles, as a polymerization inhibitor of olefins, in Diels-Alder reactions, as a paint drier, and as an oxygen stripping agent; [NTP]

Painting (Pigments, Binders, and Biocides) [Category: Paint]

General Manufacturing InformationCobaltocene: ACTIVE
응용 분야 · 2건

용도Bis(cyclopentadienyl)cobalt is used to catalyze the preparation of pyridines from alkynes and nitriles. It acts as a polymerization inhibitor of olefins. It is a common one-electron reducing agent in the laboratory. It reacts with carbon monoxide to prepare cobalt(I) derivative, cyclopentadienylcobalt dicarbonyl. It also serves as an internal standard in cyclic voltametry. Further, it finds use in Diels-Alder reactions. In addition to this, it is used as a paint drier and as an oxygen stripping agent.

일반 설명Black-purple crystals or black solid. Sublimes at 104°F and 0.1 mm Hg.

상·하류 제품 정보

상류 원료

시클로펜타디에닐화나트륨염화 코발트

관련 반응

8건
반응 기록 만들기
HRID 380230 반응식
HRID 380230촉매로uspto-grants-2001_10
HRID 637577 반응식
HRID 637577생성물로uspto-grants-1985_12
HRID 1277005 반응식
HRID 1277005촉매로uspto-grants-2000_12
HRID 1416423 반응식
HRID 1416423촉매로uspto-grants-1999_06
HRID 1458482 반응식
HRID 1458482촉매로uspto-grants-1998_12
HRID 2049117 반응식
HRID 2049117촉매로uspto-grants-1980_04
HRID 2049118 반응식
HRID 2049118촉매로uspto-grants-1980_04
HRID 2417635 반응식
HRID 2417635생성물로uspto-grants-1984_09

화합물 노트

불러오는 중…

이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
더보기
새 노트새 반응견적 요청하기
EPA
Cobaltocene (1277-43-6)

화학적 성질

dark violet crystals

Flam. Sol. 2 (100%)

안전 및 보호

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1건

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Exposure Control and Personal ProtectionBiological Exposure Indices (BEI) [ACGIH] - Cobalt in urine = 15 ug/L; sample at end of shift at end of workweek;
Nonfire Spill Response · 1건

SMALL SPILLS AND LEAKAGE: If a spill of this chemical occurs, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with acetone and transfer the dampened material to a suitable container. Use absorbent paper dampened with acetone to pick up any remaining material. Seal your contaminated clothing and the absorbent paper in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with acetone followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Isolation and EvacuationExcerpt from ERG Guide 133 [Flammable Solids]:
Minimum Risk LevelChronic Inhalation: 0.0001 mg/m3 (L134) Intermediate Oral: 0.01 mg/kg/day (L134)
Threshold Limit Values (TLV)0.02 [mg/m3], as Co
Personal Protective Equipment (PPE)MINIMUM PROTECTIVE CLOTHING: If Tyvek-type disposable protective clothing is not worn during handling of this chemical, wear disposable Tyvek-type sleeves taped to your gloves.

독성 정보

TreatmentTreatment of cobalt poisoning is symptomatic. (L29)
Health EffectsExposure to high amount of cobalt can cause heart, lung, kidney, and liver damage. Skin contact is known to result in contact dermatitis. Cobalt may also have mutagenic and carcinogenic effects. (L29, L30)
Exposure RoutesInhalation (L29) ; oral (L29) ; dermal (L29)
Toxicity Summary · 1건

Cobalt is believed to exhibit its toxicity through a oxidant-based and free radical-based processes. It produces oxygen radicals and may be oxidized to ionic cobalt, causing increased lipid peroxidation, DNA damage, and inducing certain enzymes that lead to cell apoptosis. Cobalt has also been shown to block inorganic calcium channels, possibly impairing neurotransmission. Cobalt can also chelate lipoic acids, impairing oxidation of pyruvate or fatty acids. In addition, cobalt may inhibit DNA repair by interacting with zinc finger DNA repair proteins, and has also been shown to inhibit heme synthesis and glucose metabolism. Cobalt may activate specific helper T-lymphocyte cells and interact directly with immunologic proteins, such as antibodies (IgA and IgE) or Fc receptors, resulting in immunosensitization. (L29)

Signs and SymptomsCobalt inhalation can cause asthma-like breathing problems. Skin contact is known to result in contact dermatitis, which is characterized by irritation and rashes. Ingesting large amounts of cobalt may cause nausea and vomiting. (L2090)
Carcinogen Classification2B, possibly carcinogenic to humans. (L135)
Toxicity DataLD50: 55 mg/kg (Intraperitoneal, Rat) (L495)

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
GG0350000
ridadr
UN 1325 4.1/PG 3
독성
mmo-sat 3333 mg/plate EMMUEG 19(Suppl 21),2,92
HS 번호
29319090
risk_code
11-68-42/43-40
hazard_code
F,Xn
safety_code
16-33-7/9-36/37-22
포장분류
II
위험 등급
4.1
Hazard Classifications
Carc. 2Flam. Sol. 2Muta. 2Resp. Sens. 1Skin Sens. 1
스토리지 클래스
4.1B - Flammable solid hazardous materials
테트라하이드로푸란

추가 설명

정의A metallocene.