Home Other Building Blocks 2-(prop-2-yn-1-yloxy)propanoic acid

2-(prop-2-yn-1-yloxy)propanoic acid

CAS No.:
134126-59-3
Catalog Number:
AG01AP0J
Molecular Formula:
C6H8O3
Molecular Weight:
128.1259
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Product Description
Catalog Number:
AG01AP0J
Chemical Name:
2-(prop-2-yn-1-yloxy)propanoic acid
CAS Number:
134126-59-3
Molecular Formula:
C6H8O3
Molecular Weight:
128.1259
MDL Number:
MFCD10694625
IUPAC Name:
2-prop-2-ynoxypropanoic acid
InChI:
InChI=1S/C6H8O3/c1-3-4-9-5(2)6(7)8/h1,5H,4H2,2H3,(H,7,8)
InChI Key:
ASOPQMMSXAFJQU-UHFFFAOYSA-N
SMILES:
CC(C(=O)O)OCC#C
Properties
Complexity:
142  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.047g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
128.127g/mol
Monoisotopic Mass:
128.047g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties