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1072946-43-0

1072946-43-0 | 5-Chloro-2-(morpholine-4-carbonyl)phenylboronic acid

CAS No: 1072946-43-0 Catalog No: AG003MLZ MDL No:MFCD11053808

Product Description

Catalog Number:
AG003MLZ
Chemical Name:
5-Chloro-2-(morpholine-4-carbonyl)phenylboronic acid
CAS Number:
1072946-43-0
Molecular Formula:
C11H13BClNO4
Molecular Weight:
269.4892
MDL Number:
MFCD11053808
IUPAC Name:
[5-chloro-2-(morpholine-4-carbonyl)phenyl]boronic acid
InChI:
InChI=1S/C11H13BClNO4/c13-8-1-2-9(10(7-8)12(16)17)11(15)14-3-5-18-6-4-14/h1-2,7,16-17H,3-6H2
InChI Key:
DDFIHSITKHAAKQ-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)B(O)O)C(=O)N1CCOCC1

Properties

Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.063g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
269.488g/mol
Monoisotopic Mass:
269.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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