Home Other Building Blocks 3-(METHOXYMETHYL)-1,2-OXAZOLE-5-CARBOXYLIC ACID

3-(METHOXYMETHYL)-1,2-OXAZOLE-5-CARBOXYLIC ACID

CAS No.:
1076245-91-4
Catalog Number:
AG01DUYD
Molecular Formula:
C6H7NO4
Molecular Weight:
157.1241
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Product Description
Catalog Number:
AG01DUYD
Chemical Name:
3-(METHOXYMETHYL)-1,2-OXAZOLE-5-CARBOXYLIC ACID
CAS Number:
1076245-91-4
Molecular Formula:
C6H7NO4
Molecular Weight:
157.1241
MDL Number:
MFCD20646108
IUPAC Name:
3-(methoxymethyl)-1,2-oxazole-5-carboxylic acid
InChI:
InChI=1S/C6H7NO4/c1-10-3-4-2-5(6(8)9)11-7-4/h2H,3H2,1H3,(H,8,9)
InChI Key:
FKUFYGCJOJADGN-UHFFFAOYSA-N
SMILES:
COCc1cc(on1)C(=O)O
Properties
Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.038g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
157.125g/mol
Monoisotopic Mass:
157.038g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties