Home Other Building Blocks 2-(diethyl-1,2-oxazol-4-yl)acetic acid

2-(diethyl-1,2-oxazol-4-yl)acetic acid

CAS No.:
1258641-13-2
Catalog Number:
AG019RKN
Molecular Formula:
C9H13NO3
Molecular Weight:
183.2044
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Product Description
Catalog Number:
AG019RKN
Chemical Name:
2-(diethyl-1,2-oxazol-4-yl)acetic acid
CAS Number:
1258641-13-2
Molecular Formula:
C9H13NO3
Molecular Weight:
183.2044
MDL Number:
MFCD17977232
IUPAC Name:
2-(3,5-diethyl-1,2-oxazol-4-yl)acetic acid
InChI:
InChI=1S/C9H13NO3/c1-3-7-6(5-9(11)12)8(4-2)13-10-7/h3-5H2,1-2H3,(H,11,12)
InChI Key:
FFBGKQZTUREYHB-UHFFFAOYSA-N
SMILES:
CCc1onc(c1CC(=O)O)CC
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.09g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
183.207g/mol
Monoisotopic Mass:
183.09g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties