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124022-02-2 | 3-Cyclobutene-1,2-dione, 3-ethenyl-4-methoxy-
CAS No: 124022-02-2 Catalog No: AG000LFD MDL No:
Product Description
Catalog Number:
AG000LFD
Chemical Name:
3-Cyclobutene-1,2-dione, 3-ethenyl-4-methoxy-
CAS Number:
124022-02-2
Molecular Formula:
C7H6O3
Molecular Weight:
138.1207
IUPAC Name:
3-ethenyl-4-methoxycyclobut-3-ene-1,2-dione
InChI:
InChI=1S/C7H6O3/c1-3-4-5(8)6(9)7(4)10-2/h3H,1H2,2H3
InChI Key:
OCKUUOZMOQDCCE-UHFFFAOYSA-N
SMILES:
C=CC1=C(C(=O)C1=O)OC
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.032g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.122g/mol
Monoisotopic Mass:
138.032g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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