Home Other Building Blocks 4-(oxolan-2-ylmethoxy)benzamide

4-(oxolan-2-ylmethoxy)benzamide

CAS No.:
852163-80-5
Catalog Number:
AG019MFZ
Molecular Formula:
C12H15NO3
Molecular Weight:
221.2524
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Product Description
Catalog Number:
AG019MFZ
Chemical Name:
4-(oxolan-2-ylmethoxy)benzamide
CAS Number:
852163-80-5
Molecular Formula:
C12H15NO3
Molecular Weight:
221.2524
MDL Number:
MFCD07295846
IUPAC Name:
4-(oxolan-2-ylmethoxy)benzamide
InChI:
InChI=1S/C12H15NO3/c13-12(14)9-3-5-10(6-4-9)16-8-11-2-1-7-15-11/h3-6,11H,1-2,7-8H2,(H2,13,14)
InChI Key:
NBXYEYDZHYVHFD-UHFFFAOYSA-N
SMILES:
NC(=O)c1ccc(cc1)OCC1CCCO1
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.105g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.256g/mol
Monoisotopic Mass:
221.105g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties