GRELA CATALYST

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H26N2.C10H11NO3.2Cl.Ru
Molecular Weight	671.62
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Cl-].[Cl-].[Ru+6].CC(C)OC1=C([CH--])C=C(C=C1)[N+]([O-])=O.CC2=CC(C)=C(N3CCN([C--]3)C4=C(C)C=C(C)C=C4C)C(C)=C2

InChI

InChIKey=RHBYTIXFTKMQOU-UHFFFAOYSA-L

InChI=1S/C21H26N2.C10H11NO3.2ClH.Ru/c1-14-9-16(3)20(17(4)10-14)22-7-8-23(13-22)21-18(5)11-15(2)12-19(21)6;1-7(2)14-10-5-4-9(11(12)13)6-8(10)3;;;/h9-12H,7-8H2,1-6H3;3-7H,1-2H3;2*1H;/q2*-2;;;+6/p-2

HIDE SMILES / InChI

Molecular Formula	C21H26N2
Molecular Weight	306.4445
Charge	-2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C10H11NO3
Molecular Weight	193.1992
Charge	-2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	Cl
Molecular Weight	35.453
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	Ru
Molecular Weight	101.07
Charge	6
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 05:58:44 GMT 2025` Edited by `admin` on `Wed Apr 02 05:58:44 GMT 2025`
Record UNII	HS189WSW8J
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GRELA CATALYST

Common Name

English

RUTHENIUM, (1,3-BIS(2,4,6-TRIMETHYLPHENYL)-2-IMIDAZOLIDINYLIDENE)DICHLORO((2-(1-METHYLETHOXY-.KAPPA.O)-5-NITROPHENYL)METHYLENE-.KAPPA.C)-, (SP-5-41)-

Preferred Name

English

Code System Code Type Description

FDA UNII

HS189WSW8J

Created by admin on Wed Apr 02 05:58:44 GMT 2025 , Edited by admin on Wed Apr 02 05:58:44 GMT 2025

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MERCK INDEX

m11771

Created by admin on Wed Apr 02 05:58:44 GMT 2025 , Edited by admin on Wed Apr 02 05:58:44 GMT 2025

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CAS

502964-52-5

Created by admin on Wed Apr 02 05:58:44 GMT 2025 , Edited by admin on Wed Apr 02 05:58:44 GMT 2025

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