Home Carboxys 3-cyclopropyl-5-methyl-1,2-oxazole-4-carboxylic acid

3-cyclopropyl-5-methyl-1,2-oxazole-4-carboxylic acid

CAS No.:
1082420-70-9
Catalog Number:
AG01AFLR
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
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Product Description
Catalog Number:
AG01AFLR
Chemical Name:
3-cyclopropyl-5-methyl-1,2-oxazole-4-carboxylic acid
CAS Number:
1082420-70-9
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD11584319
IUPAC Name:
3-cyclopropyl-5-methyl-1,2-oxazole-4-carboxylic acid
InChI:
InChI=1S/C8H9NO3/c1-4-6(8(10)11)7(9-12-4)5-2-3-5/h5H,2-3H2,1H3,(H,10,11)
InChI Key:
UZLVDVUHBYMQBT-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(C)onc1C1CC1
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties