Home Carboxys 1-(4-hydroxyoxan-4-yl)cyclopropane-1-carboxylic acid

1-(4-hydroxyoxan-4-yl)cyclopropane-1-carboxylic acid

CAS No.:
1447944-13-9
Catalog Number:
AG01EKSJ
Molecular Formula:
C9H14O4
Molecular Weight:
186.2051
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Product Description
Catalog Number:
AG01EKSJ
Chemical Name:
1-(4-hydroxyoxan-4-yl)cyclopropane-1-carboxylic acid
CAS Number:
1447944-13-9
Molecular Formula:
C9H14O4
Molecular Weight:
186.2051
MDL Number:
MFCD31650027
IUPAC Name:
1-(4-hydroxyoxan-4-yl)cyclopropane-1-carboxylic acid
InChI:
InChI=1S/C9H14O4/c10-7(11)8(1-2-8)9(12)3-5-13-6-4-9/h12H,1-6H2,(H,10,11)
InChI Key:
VZRKQOQTRDWING-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CC1)C1(O)CCOCC1
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.089g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
186.207g/mol
Monoisotopic Mass:
186.089g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties