Home Carboxys 4-(methoxymethyl)oxane-4-carboxylic acid

4-(methoxymethyl)oxane-4-carboxylic acid

CAS No.:
1210226-46-2
Catalog Number:
AG01BCJA
Molecular Formula:
C8H14O4
Molecular Weight:
174.1944
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Product Description
Catalog Number:
AG01BCJA
Chemical Name:
4-(methoxymethyl)oxane-4-carboxylic acid
CAS Number:
1210226-46-2
Molecular Formula:
C8H14O4
Molecular Weight:
174.1944
MDL Number:
MFCD19374581
IUPAC Name:
4-(methoxymethyl)oxane-4-carboxylic acid
InChI:
InChI=1S/C8H14O4/c1-11-6-8(7(9)10)2-4-12-5-3-8/h2-6H2,1H3,(H,9,10)
InChI Key:
HFIXVNNCONWPOR-UHFFFAOYSA-N
SMILES:
COCC1(CCOCC1)C(=O)O
Properties
Complexity:
160  
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties