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Home > Boronic Acids > 1150271-72-9
1150271-72-9 | Morpholine, 4-[3-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propyl]-, hydrochloride (1:1)
CAS No: 1150271-72-9 Catalog No: AG000FQH MDL No:MFCD12026080
Product Description
Catalog Number:
AG000FQH
Chemical Name:
Morpholine, 4-[3-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propyl]-, hydrochloride (1:1)
CAS Number:
1150271-72-9
Molecular Formula:
C19H31BClNO3
Molecular Weight:
367.7183
MDL Number:
MFCD12026080
IUPAC Name:
4-[3-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propyl]morpholine;hydrochloride
InChI:
InChI=1S/C19H30BNO3.ClH/c1-18(2)19(3,4)24-20(23-18)17-9-5-7-16(15-17)8-6-10-21-11-13-22-14-12-21;/h5,7,9,15H,6,8,10-14H2,1-4H3;1H
InChI Key:
WRGYYSFBZXNKLL-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cccc(c1)CCCN1CCOCC1.Cl
Properties
Complexity:
393
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.209g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
367.721g/mol
Monoisotopic Mass:
367.209g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
30.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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