Home Carboxys 2-(oxolan-2-yl)oxolane-2-carboxylic acid

2-(oxolan-2-yl)oxolane-2-carboxylic acid

CAS No.:
2145498-17-3
Catalog Number:
AG01EKML
Molecular Formula:
C9H14O4
Molecular Weight:
186.2051
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Product Description
Catalog Number:
AG01EKML
Chemical Name:
2-(oxolan-2-yl)oxolane-2-carboxylic acid
CAS Number:
2145498-17-3
Molecular Formula:
C9H14O4
Molecular Weight:
186.2051
MDL Number:
MFCD31616817
IUPAC Name:
2-(oxolan-2-yl)oxolane-2-carboxylic acid
InChI:
InChI=1S/C9H14O4/c10-8(11)9(4-2-6-13-9)7-3-1-5-12-7/h7H,1-6H2,(H,10,11)
InChI Key:
LSZBEWSMXRIPLZ-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CCCO1)C1CCCO1
Properties
Complexity:
216  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
186.207g/mol
Monoisotopic Mass:
186.089g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties