Home Other Building Blocks Benzenemethanamine, N-(4-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-

Benzenemethanamine, N-(4-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-

CAS No.:
1454653-66-7
Catalog Number:
AG01FFYS
Molecular Formula:
C20H26BNO3
Molecular Weight:
339.2363
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Product Description
Catalog Number:
AG01FFYS
Chemical Name:
Benzenemethanamine, N-(4-methoxyphenyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
1454653-66-7
Molecular Formula:
C20H26BNO3
Molecular Weight:
339.2363
MDL Number:
MFCD28166893
IUPAC Name:
4-methoxy-N-[[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl]aniline
InChI:
InChI=1S/C20H26BNO3/c1-19(2)20(3,4)25-21(24-19)16-8-6-7-15(13-16)14-22-17-9-11-18(23-5)12-10-17/h6-13,22H,14H2,1-5H3
InChI Key:
JQDIUHIUXGMSRK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NCc1cccc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
419  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.201g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
339.242g/mol
Monoisotopic Mass:
339.201g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
39.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties