Home Other Building Blocks 4-methoxy-3-methylbut-2-enoic acid

4-methoxy-3-methylbut-2-enoic acid

CAS No.:
61934-58-5
Catalog Number:
AG01AE1P
Molecular Formula:
C6H10O3
Molecular Weight:
130.1418
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Product Description
Catalog Number:
AG01AE1P
Chemical Name:
4-methoxy-3-methylbut-2-enoic acid
CAS Number:
61934-58-5
Molecular Formula:
C6H10O3
Molecular Weight:
130.1418
IUPAC Name:
4-methoxy-3-methylbut-2-enoic acid
InChI:
InChI=1S/C6H10O3/c1-5(4-9-2)3-6(7)8/h3H,4H2,1-2H3,(H,7,8)
InChI Key:
XMWPDIJGUVKUMU-UHFFFAOYSA-N
SMILES:
CC(=CC(=O)O)COC
Properties
Complexity:
126  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.063g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
130.143g/mol
Monoisotopic Mass:
130.063g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
0.5  
Properties