({6-[(di-tert-butylphosphanyl)methyl]pyridin-2-yl}methyl)diethylamine; chloro(hydrido)ruthenium; oxomethylidene

({6-[(di-tert-butylphosphanyl)methyl]pyridin-2-yl}methyl)diethylamine; chloro(hydrido)ruthenium; oxomethylidene

CAS: 863971-62-4

Formula: C20H36ClN2OPRu

SMILES: Cl[RuH].[C]=O.CCN(CC)CC1=CC=CC(CP(C(C)(C)C)C(C)(C)C)=N1

IUPAC: ({6-[(di-tert-butylphosphanyl)methyl]pyridin-2-yl}methyl)diethylamine; chloro(hydrido)ruthenium; oxomethylidene

InChI: InChI=1S/C19H35N2P.CO.ClH.Ru.H/c1-9-21(10-2)14-16-12-11-13-17(20-16)15-22(18(3,4)5)19(6,7)8;1-2;;;/h11-13H,9-10,14-15H2,1-8H3;;1H;;/q;;;+1;/p-1

Composition: C (49.22%), H (7.44%), Cl (7.26%), N (5.74%), O (3.28%), P (6.35%), Ru (20.71%)

Molar Mass: 488.01

Atom Count: 62

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	488.129722
Formal Charge	0
FSP3	0.7
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	RZCAJPSOQUIHSH-UHFFFAOYSA-M
Lipinski's Rule of Five	1
Molar Refractivity	104.16
Topological Polar Surface Area	16.13
Polarizability	39.5
Ring Count	1
Rotatable Bond Count	8

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