AG003BH2

539834-19-0 | 6,6'-(((1R,2R,4R,5R)-Bicyclo[2.2.1]heptane-2,5-diylbis(azanylylidene))bis(methanylylidene))bis(2,4-di-tert-butylphenol)

AG003BH2

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CAS Number	539834-19-0
Catalog Number	AG003BH2(AGN-PC-0SG6J5)
Chemical Name	6,6'-(((1R,2R,4R,5R)-Bicyclo[2.2.1]heptane-2,5-diylbis(azanylylidene))bis(methanylylidene))bis(2,4-di-tert-butylphenol)
IUPAC Name	2,4-ditert-butyl-6-[[5-[(3,5-ditert-butyl-2-hydroxyphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]phenol
InChI	InChI=1S/C37H54N2O2/c1-34(2,3)26-14-24(32(40)28(18-26)36(7,8)9)20-38-30-16-23-13-22(30)17-31(23)39-21-25-15-27(35(4,5)6)19-29(33(25)41)37(10,11)12/h14-15,18-23,30-31,40-41H,13,16-17H2,1-12H3
InChI Key	WDMYJUKMBXUTIA-UHFFFAOYSA-N
MDL Number	MFCD08276289
Molecular Formula	C37H54N2O2
Molecular Weight	558.8369
SMILES	CC(C)(C)C1=CC(C=N[C@@H]2C[C@H]3C[C@@H]2C[C@H]3N=CC2=C(O)C(=CC(=C2)C(C)(C)C)C(C)(C)C)=C(O)C(=C1)C(C)(C)C
Synonyms	539834-19-0, 6,6'-(((1R,2R,4R,5R)-Bicyclo[2.2.1]heptane-2,5-diylbis(azanylylidene))bis(methanylylidene))bis(2,4-di-tert-butylphenol), (1R,2R,4R,5R)-2,5-Bis(3,5-di-tert-butyl-2-hydroxybenzylideneamino)bicyclo[2.2.1]heptane, ACMC-209lbo, ACMC-209lbp, MFCD08276289, MFCD08276290, AKOS027320774, AKOS030231232, TRA0012609, TRA-0204834, B2652, B2653, N,N'-(Bicyclo[2.2.1]heptane-2,5-diyl)bis(3,5-di-tert-butyl-2-hydroxybenzenemethaneimine), 2,2'-[(1R,2R,4R,5R)-Bicyclo[2.2.1]heptane-2,5-diylbis(nitrilomethyl)]bis(4,6-di-tert-butylphenol), 2,2'-[(1S,2S,4S,5S)-Bicyclo[2.2.1]heptane-2,5-diylbis(nitrilomethyl)]bis(4,6-di-tert-butylphenol), (1S,2S,4S,5S)-2,5-Bis(3,5-di-tert-butyl-2-hydroxybenzylideneamino)bicyclo[2.2.1]heptane, 539834-16-7, 106809-14-7, 106825-81-4,

Complexity	866
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	558.419g/mol
Formal Charge	0
Heavy Atom Count	41
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	558.851g/mol
Monoisotopic Mass	558.419g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	65.2A^2
Undefined Atom Stereocenter Count	4
Undefined Bond Stereocenter Count	0
XLogP3	9.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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