Home Carboxys 3-(propan-2-yloxy)oxolane-3-carboxylic acid

3-(propan-2-yloxy)oxolane-3-carboxylic acid

CAS No.:
1861329-36-3
Catalog Number:
AG01AUDC
Molecular Formula:
C8H14O4
Molecular Weight:
174.1944
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Product Description
Catalog Number:
AG01AUDC
Chemical Name:
3-(propan-2-yloxy)oxolane-3-carboxylic acid
CAS Number:
1861329-36-3
Molecular Formula:
C8H14O4
Molecular Weight:
174.1944
MDL Number:
MFCD29047203
IUPAC Name:
3-propan-2-yloxyoxolane-3-carboxylic acid
InChI:
InChI=1S/C8H14O4/c1-6(2)12-8(7(9)10)3-4-11-5-8/h6H,3-5H2,1-2H3,(H,9,10)
InChI Key:
KCBQLROLGFBFSA-UHFFFAOYSA-N
SMILES:
CC(OC1(COCC1)C(=O)O)C
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.089g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
174.196g/mol
Monoisotopic Mass:
174.089g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties