Home Carboxys 3-(2-methylcyclopropyl)-1,2-oxazole-4-carboxylic acid

3-(2-methylcyclopropyl)-1,2-oxazole-4-carboxylic acid

CAS No.:
2144373-91-9
Catalog Number:
AG01DZ9D
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
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Product Description
Catalog Number:
AG01DZ9D
Chemical Name:
3-(2-methylcyclopropyl)-1,2-oxazole-4-carboxylic acid
CAS Number:
2144373-91-9
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD30688269
IUPAC Name:
3-(2-methylcyclopropyl)-1,2-oxazole-4-carboxylic acid
InChI:
InChI=1S/C8H9NO3/c1-4-2-5(4)7-6(8(10)11)3-12-9-7/h3-5H,2H2,1H3,(H,10,11)
InChI Key:
CBJUTYVSYLOKGM-UHFFFAOYSA-N
SMILES:
CC1CC1c1nocc1C(=O)O
Properties
Complexity:
207  
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:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties