Home Other Building Blocks (2-FORMYL-OXAZOL-4-YL)-ACETIC ACID METHYL ESTER

(2-FORMYL-OXAZOL-4-YL)-ACETIC ACID METHYL ESTER

CAS No.:
1554332-58-9
Catalog Number:
AG01EM97
Molecular Formula:
C7H7NO4
Molecular Weight:
169.1348
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Product Description
Catalog Number:
AG01EM97
Chemical Name:
(2-FORMYL-OXAZOL-4-YL)-ACETIC ACID METHYL ESTER
CAS Number:
1554332-58-9
Molecular Formula:
C7H7NO4
Molecular Weight:
169.1348
MDL Number:
MFCD26743214
IUPAC Name:
methyl 2-(2-formyl-1,3-oxazol-4-yl)acetate
InChI:
InChI=1S/C7H7NO4/c1-11-7(10)2-5-4-12-6(3-9)8-5/h3-4H,2H2,1H3
InChI Key:
VILXWGUOGCEECZ-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1coc(n1)C=O
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.038g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.136g/mol
Monoisotopic Mass:
169.038g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties