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1042917-51-0 | tert-butyl 4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1,4-diazepane-1-carboxylate
CAS No: 1042917-51-0 Catalog No: AG0091AC MDL No:
Product Description
Catalog Number:
AG0091AC
Chemical Name:
tert-butyl 4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1,4-diazepane-1-carboxylate
CAS Number:
1042917-51-0
IUPAC Name:
tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,4-diazepane-1-carboxylate
InChI:
InChI=1S/C22H35BN2O4/c1-20(2,3)27-19(26)25-14-8-13-24(15-16-25)18-11-9-17(10-12-18)23-28-21(4,5)22(6,7)29-23/h9-12H,8,13-16H2,1-7H3
InChI Key:
HAUHQMFBNQGAGJ-UHFFFAOYSA-N
Properties
Complexity:
566
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
402.269g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
402.342g/mol
Monoisotopic Mass:
402.269g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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