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19406-00-9

19406-00-9 | Methyl 2-oxotetrahydrofuran-3-carboxylate

CAS No: 19406-00-9 Catalog No: AG00387D MDL No:MFCD10569624

Product Description

Catalog Number:
AG00387D
Chemical Name:
Methyl 2-oxotetrahydrofuran-3-carboxylate
CAS Number:
19406-00-9
Molecular Formula:
C6H8O4
Molecular Weight:
144.1253
MDL Number:
MFCD10569624
IUPAC Name:
methyl 2-oxooxolane-3-carboxylate
InChI:
InChI=1S/C6H8O4/c1-9-5(7)4-2-3-10-6(4)8/h4H,2-3H2,1H3
InChI Key:
KBFOCDFPJBIMBD-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCOC1=O
NSC Number:
238957

Properties

Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.042g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.126g/mol
Monoisotopic Mass:
144.042g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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