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

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

CAS No.:
1781976-43-9
Catalog Number:
AG01BAK8
Molecular Formula:
C7H7NO3
Molecular Weight:
153.1354
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Product Description
Catalog Number:
AG01BAK8
Chemical Name:
4-cyclopropyl-1,3-oxazole-5-carboxylic acid
CAS Number:
1781976-43-9
Molecular Formula:
C7H7NO3
Molecular Weight:
153.1354
MDL Number:
MFCD28505744
IUPAC Name:
4-cyclopropyl-1,3-oxazole-5-carboxylic acid
InChI:
InChI=1S/C7H7NO3/c9-7(10)6-5(4-1-2-4)8-3-11-6/h3-4H,1-2H2,(H,9,10)
InChI Key:
YRBSRELYCRKVTD-UHFFFAOYSA-N
SMILES:
OC(=O)c1ocnc1C1CC1
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.043g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
153.137g/mol
Monoisotopic Mass:
153.043g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties