Home Other Building Blocks 2-(2-OXO-2,3-DIHYDRO-1,3-BENZOXAZOL-5-YL)ACETIC ACID

2-(2-OXO-2,3-DIHYDRO-1,3-BENZOXAZOL-5-YL)ACETIC ACID

CAS No.:
171056-70-5
Catalog Number:
AG01DSV7
Molecular Formula:
C9H7NO4
Molecular Weight:
193.1562
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Product Description
Catalog Number:
AG01DSV7
Chemical Name:
2-(2-OXO-2,3-DIHYDRO-1,3-BENZOXAZOL-5-YL)ACETIC ACID
CAS Number:
171056-70-5
Molecular Formula:
C9H7NO4
Molecular Weight:
193.1562
MDL Number:
MFCD21985193
IUPAC Name:
2-(2-oxo-3H-1,3-benzoxazol-5-yl)acetic acid
InChI:
InChI=1S/C9H7NO4/c11-8(12)4-5-1-2-7-6(3-5)10-9(13)14-7/h1-3H,4H2,(H,10,13)(H,11,12)
InChI Key:
RGILNTVPXDNGOE-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1ccc2c(c1)[nH]c(=O)o2
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.038g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
193.158g/mol
Monoisotopic Mass:
193.038g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties