Home Halogens 4-chloro-3-(morpholin-4-yl)benzoic acid

4-chloro-3-(morpholin-4-yl)benzoic acid

CAS No.:
886501-46-8
Catalog Number:
AG01A69I
Molecular Formula:
C11H12ClNO3
Molecular Weight:
241.6709
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Product Description
Catalog Number:
AG01A69I
Chemical Name:
4-chloro-3-(morpholin-4-yl)benzoic acid
CAS Number:
886501-46-8
Molecular Formula:
C11H12ClNO3
Molecular Weight:
241.6709
MDL Number:
MFCD06740116
IUPAC Name:
4-chloro-3-morpholin-4-ylbenzoic acid
InChI:
InChI=1S/C11H12ClNO3/c12-9-2-1-8(11(14)15)7-10(9)13-3-5-16-6-4-13/h1-2,7H,3-6H2,(H,14,15)
InChI Key:
DHQJUAWXZZYMHR-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)N1CCOCC1)Cl
Properties
Complexity:
256  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.051g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
241.671g/mol
Monoisotopic Mass:
241.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties