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Home > Boronic Acids > 1361110-63-5
1361110-63-5 | 4-(2-Chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);phenyl);morpholine
CAS No: 1361110-63-5 Catalog No: AG003J8P MDL No:MFCD18070979
Product Description
Catalog Number:
AG003J8P
Chemical Name:
4-(2-Chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl);phenyl);morpholine
CAS Number:
1361110-63-5
Molecular Formula:
C16H23BClNO3
Molecular Weight:
323.6227
MDL Number:
MFCD18070979
IUPAC Name:
4-[2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]morpholine
InChI:
InChI=1S/C16H23BClNO3/c1-15(2)16(3,4)22-17(21-15)12-5-6-14(13(18)11-12)19-7-9-20-10-8-19/h5-6,11H,7-10H2,1-4H3
InChI Key:
SKJAWVMUHVUHMM-UHFFFAOYSA-N
SMILES:
Clc1cc(ccc1N1CCOCC1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.146g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.624g/mol
Monoisotopic Mass:
323.146g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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