(1R,2R,4R,5R)-2,5-Bis(3,5-di-tert-butyl-2-hydroxybenzylideneamino)bicyclo[2.2.1]heptane

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Catalog Number
ACM539834190
Product Name
(1R,2R,4R,5R)-2,5-Bis(3,5-di-tert-butyl-2-hydroxybenzylideneamino)bicyclo[2.2.1]heptane
Structure
Structure
CAS
539834-19-0
Category
Heterocyclic Organic Compound
Synonyms
MFCD08276290; N,N'-(Bicyclo[2.2.1]heptane-2,5-diyl)bis(3,5-di-tert-butyl-2-hydroxybenzenemethaneimine); B2653; B2652; TRA0012609; ACMC-209lbo; MFCD08276289;
IUPAC Name
2,4-ditert-butyl-6-[[5-[(3,5-ditert-butyl-2-hydroxyphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]phenol;
Molecular Weight
558.851g/mol
Molecular Formula
C37H54N2O2;
Canonical SMILES
CC(C)(C)C1=CC(=C(C(=C1)C=NC2CC3CC2CC3N=CC4=CC(=CC(=C4O)C(C)(C)C)C(C)(C)C)O)C(C)(C)C;
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;
Complexity
866
Covalently-Bonded Unit Count
1
Exact Mass
558.419g/mol
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
41
Monoisotopic Mass
558.419g/mol
Rotatable Bond Count
8
Topological Polar Surface Area
65.2A^2
Undefined Atom Stereocenter Count
4
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