Home Other Building Blocks 4-[(2,6-dimethylmorpholin-4-yl)methyl]benzoic acid

4-[(2,6-dimethylmorpholin-4-yl)methyl]benzoic acid

CAS No.:
926198-81-4
Catalog Number:
AG019MHP
Molecular Formula:
C14H19NO3
Molecular Weight:
249.3056
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Product Description
Catalog Number:
AG019MHP
Chemical Name:
4-[(2,6-dimethylmorpholin-4-yl)methyl]benzoic acid
CAS Number:
926198-81-4
Molecular Formula:
C14H19NO3
Molecular Weight:
249.3056
MDL Number:
MFCD09047225
IUPAC Name:
4-[(2,6-dimethylmorpholin-4-yl)methyl]benzoic acid
InChI:
InChI=1S/C14H19NO3/c1-10-7-15(8-11(2)18-10)9-12-3-5-13(6-4-12)14(16)17/h3-6,10-11H,7-9H2,1-2H3,(H,16,17)
InChI Key:
PDXOUFOUVXIPDL-UHFFFAOYSA-N
SMILES:
CC1OC(C)CN(C1)Cc1ccc(cc1)C(=O)O
Properties
Complexity:
277  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.136g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
249.31g/mol
Monoisotopic Mass:
249.136g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties