Home Other Building Blocks 2-(oxan-2-ylmethoxy)propanoic acid

2-(oxan-2-ylmethoxy)propanoic acid

CAS No.:
1016846-06-2
Catalog Number:
AG019Y3Y
Molecular Formula:
C9H16O4
Molecular Weight:
188.2209
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Product Description
Catalog Number:
AG019Y3Y
Chemical Name:
2-(oxan-2-ylmethoxy)propanoic acid
CAS Number:
1016846-06-2
Molecular Formula:
C9H16O4
Molecular Weight:
188.2209
MDL Number:
MFCD09949864
IUPAC Name:
2-(oxan-2-ylmethoxy)propanoic acid
InChI:
InChI=1S/C9H16O4/c1-7(9(10)11)13-6-8-4-2-3-5-12-8/h7-8H,2-6H2,1H3,(H,10,11)
InChI Key:
IRLQQMAIHXIZDR-UHFFFAOYSA-N
SMILES:
OC(=O)C(OCC1CCCCO1)C
Properties
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.105g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.223g/mol
Monoisotopic Mass:
188.105g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties