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catMETium RF1

HCID 72376331
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
254972-49-1
Standard SMILES
C1CCC(P(C2CCCCC2)C2CCCCC2)CC1.Cc1cc(C)c(-n2ccn(-c3c(C)cc(C)cc3C)[c]2=[Ru]([Cl])([Cl])=[C]2C=C(c3ccccc3)c3ccccc32)c(C)c1
InChIKey
HBNBIWQQLMQFEU-UHFFFAOYSA-L
Molecular formula
C54H67Cl2N2PRu
Average molar mass
947.1 g/mol
Monoisotopic mass
946.346233

Names & identifiers

Preferred name
catMETium RF1
IUPAC
[1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]-dichloro-(3-phenylinden-1-ylidene)ruthenium;tricyclohexylphosphane
English name
TRICYCLOHEXYLPHOSPHINE[1,3-BIS(2,4,6-TRIMETHYLPHENYL)IMIDAZOL-2-YLIDENE][3-PHENYL-1H-INDEN-1-YLIDENE]RUTHENIUM (II) DICHLORIDE
Molecular formula
C54H67Cl2N2PRu
Molecular weight
947.07

Names & synonyms

254972-49-1catMETium RF1[1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]-dichloro-(3-phenylinden-1-ylidene)ruthenium;tricyclohexylphosphanecatMETium(R) RF1, 95%SCHEMBL1928364SCHEMBL29699282Tricyclohexylphosphine[1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene][3-phenyl-1H-inden-1-ylidene]ruthenium(II)dichlorideNeolyst UGrubbs catalyst? M203[1,3-Bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]-dichloro-(3-phenylinden-1-ylidene)rutheniumTricyclohexylphosphine[1,3-bis(2,4,6-trimethylphenyl)imidazol-2-ylidene][3-phenyl-1H-inden-1-ylidene]ruthenium(II) dichl(1,3-bis-(2,4,6-trimethylphenyl)imidazol-2-ylidene)(tricyclohexylphosphine)(3-phenylinden-1-ylidene)ruthenium(IV)dichloride
Show more names
[1,3-Bis(2,4,6-trimethylphenyl)imidazol-2-ylidene]dichloro(3-phenyl-1H-inden-1-ylidene)(tricyclohexylphosphine)ruthenium(II)TRICYCLOHEXYLPHOSPHINE [1,3-BIS(2,4,6-TRIMETHYLPHENYL)IMIDAZOL-2-YLIDENE][3-PHENYL-1H-INDEN-1-YLIDENE] RUTHENIUM (II) DICHLOR

Properties

Computed structural properties

Topological polar surface area
6.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
60
Formal charge
0
Complexity
1,290

Physicochemical properties

Melting point
230 °C · 230°C (decomp)
storage temp.
2 · 2-8°C, protect from light, stored under nitrogen
form
Powder
color
orange to brown
InChIKey
HBNBIWQQLMQFEU-UHFFFAOYSA-L
SMILES
CC1=CC(C)=CC(C)=C1n2c([Ru](Cl)(Cl)(P(C3CCCCC3)(C4CCCCC4)C5CCCCC5)=C6C(C=CC=C7)=C7C(C8=CC=CC=C8)=C6)n(C9=C(C)C=C(C)C=C9C)C=C2
UNSPSC Code
12352103 · 12352103
NACRES
22 · NA.22
Symbol(GHS)
2 · GHS02
Signal word
Danger
Hazard statements
251 · H251
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36/37/39
WGK Germany
3 · WGK 3
Storage Class
11 · 11 - Combustible Solids

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H228 (95.7%): Flammable solid [Danger Flammable solids]

P210, P235, P240, P241, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P407, P410, P413, P420, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 23 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesFlam. Sol. 1 (95.7%)

Safety data

wgk
WGK 3
risk_code
36/37/38
Signal word
Danger
Symbol(GHS)
GHS02
safety_code
26-36/37/39
Storage Class
11 - Combustible Solids
Hazard statements
H251

Chemistry & industry

Applications

UsesUmicore Grubbs Catalyst M203 is a homogeneous catalyst useful for alkene metathesis, especially for cross-metathesis, ring-closing metathesis and self-metathesis.Learn more about our metathesis catalysts

Suppliers29 total

苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
上海茵凯化学科技有限公司021-57603038 13601791340;13818007232 · [email protected]
北京国方鼎盛科技有限公司18610472091 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
南京艾比克斯生化科技有限公司

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
TRICYCLOHEXYLPHOSPHINE[1,3-BIS(2,4,6-TRIMETHYLPHENYL)IMIDAZOL-2-YLIDENE][3-PHENYL-1H-INDEN-1-YLIDENE]RUTHENIUM (II) DICHLORIDE
Tricyclohexylphosphine[1,3-bis(2,4,6-triMethylphenyl)iMidazol-2-ylidene][3-phenyl-1H-inden-1-ylidene]rutheniuM(II) dichloride,95%

Database identifiers

CAS
254972-49-1
PubChem CID
72376331
EC Number
682-128-2
025-87193546 18652950785 · [email protected]
郑州金一化工科技有限公司0371-65511006 18625597674 · [email protected]
天津凯利奇生物科技有限公司15076683720 · [email protected]
小辣椒试剂021-60702684 18516024827 · [email protected]
上海万千化工有限公司18796480002 18796480002 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
武汉膦配巴生物医药有限公司15102702255 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
Changzhou Ansciep Chemical Co., Ltd.+86 519 86305871 · [email protected]
河南威梯希化工科技有限公司0371-63284658 18135795563 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
乐山邦盛新材料科技有限公司0833-2599138 19162614312 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Richest Group Ltd18017061086 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
武汉子泰科技有限公司13995588728 · [email protected]