Home Carboxys 2-(methoxymethyl)oxolane-2-carboxylic acid

2-(methoxymethyl)oxolane-2-carboxylic acid

CAS No.:
1832579-71-1
Catalog Number:
AG01DZ40
Molecular Formula:
C7H12O4
Molecular Weight:
160.1678
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Product Description
Catalog Number:
AG01DZ40
Chemical Name:
2-(methoxymethyl)oxolane-2-carboxylic acid
CAS Number:
1832579-71-1
Molecular Formula:
C7H12O4
Molecular Weight:
160.1678
MDL Number:
MFCD31615515
IUPAC Name:
2-(methoxymethyl)oxolane-2-carboxylic acid
InChI:
InChI=1S/C7H12O4/c1-10-5-7(6(8)9)3-2-4-11-7/h2-5H2,1H3,(H,8,9)
InChI Key:
TXQUMVNVQOBYDT-UHFFFAOYSA-N
SMILES:
COCC1(CCCO1)C(=O)O
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.074g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
160.169g/mol
Monoisotopic Mass:
160.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties