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101774-07-6 | 1-Cyclobutene-1,2-dicarboxylic acid, 3-ethenyl-, 1,2-dimethyl ester
CAS No: 101774-07-6 Catalog No: AG0005GK MDL No:
Product Description
Catalog Number:
AG0005GK
Chemical Name:
1-Cyclobutene-1,2-dicarboxylic acid, 3-ethenyl-, 1,2-dimethyl ester
CAS Number:
101774-07-6
Molecular Formula:
C10H12O4
Molecular Weight:
196.1999
IUPAC Name:
dimethyl 3-ethenylcyclobutene-1,2-dicarboxylate
InChI:
InChI=1S/C10H12O4/c1-4-6-5-7(9(11)13-2)8(6)10(12)14-3/h4,6H,1,5H2,2-3H3
InChI Key:
MFFIPVCGDAAMPW-UHFFFAOYSA-N
SMILES:
COC(=O)C1=C(CC1C=C)C(=O)OC
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.202g/mol
Monoisotopic Mass:
196.074g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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