(S,S)-(+)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediaminomanganese(III) chloride - CAS 135620-04-1

Name: (S,S)-(+)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediaminomanganese(III) chloride
Brand: BOC Sciences
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Catalog:	BB008226
Product Name:	(S,S)-(+)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediaminomanganese(III) chloride
CAS:	135620-04-1
Synonyms:	2,4-ditert-butyl-6-[[(1S,2S)-2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylideneamino]cyclohexyl]iminomethyl]phenol;manganese(3+);trichloride

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IUPAC Name:	2,4-ditert-butyl-6-[[(1S,2S)-2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylideneamino]cyclohexyl]iminomethyl]phenol;manganese(3+);trichloride
Description:	(S,S)-(+)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediaminomanganese(III) chloride (CAS# 135620-04-1) is a useful research chemical compound.
Molecular Weight:	635.20
Molecular Formula:	C36H54Cl3MnN2O2
Canonical SMILES:	CC(C)(C)C1=CC(=C(C(=C1)C=NC2CCCCC2N=CC3=CC(=CC(=C3O)C(C)(C)C)C(C)(C)C)O)C(C)(C)C.[Cl-].[Cl-].[Cl-].[Mn+3]
InChI:	InChI=1S/C36H54N2O2.3ClH.Mn/c1-33(2,3)25-17-23(31(39)27(19-25)35(7,8)9)21-37-29-15-13-14-16-30(29)38-22-24-18-26(34(4,5)6)20-28(32(24)40)36(10,11)12;;;;/h17-22,29-30,39-40H,13-16H2,1-12H3;3*1H;/q;;;;+3/p-3/t29-,30-;;;;/m0..../s1
InChI Key:	VGAJDQCIDNCJQC-FTKQXCDWSA-K
Melting Point:	330-332 °C (lit.)
Purity:	95 %
Appearance:	Dark brown powder
Storage:	Inert atmosphere, Room Temperature
MDL:	MFCD02101663
LogP:	0.14900

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
EP-0913396-B1	Sulphonamide substituted benzopyran derivatives, process of preparation, their use as medicines and pharmaceutical compositions containing them	19971103
SK-149498-A3	Sulphonamide substituted benzopyran derivatives, process of preparation, their use as medicines and pharmaceutical compositions containing them	19971103
SK-284859-B6	Sulphonamide substituted benzopyran derivatives, process for their preparation, their use as medicaments and pharmaceutical compositions containing them	19971103
DE-69333240-T2	METHOD FOR PRODUCING ENANTIOMINE-PURIFIED FLUORINATED EPOXYCHROMANN	19920220
KR-100245205-B1	Method for preparing enantiomerically pure fluorinated epoxy blacks	19920220

Complexity:	793
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	5
Defined Atom Stereocenter Count:	2
Defined Bond Stereocenter Count:	0
Exact Mass:	706.263130
Formal Charge:	0
Heavy Atom Count:	44
Hydrogen Bond Acceptor Count:	7
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	706.263130
Rotatable Bond Count:	8
Topological Polar Surface Area:	65.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0

(S,S)-(+)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediaminomanganese(III) chloride - CAS 135620-04-1

Technical Data

Safety and Hazards

Patents

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