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149360-80-5 | Propanedioic acid, methylene-, cyclohexyl ethyl ester, homopolymer (9CI)
CAS No: 149360-80-5 Catalog No: AG001LM3 MDL No:
Product Description
Catalog Number:
AG001LM3
Chemical Name:
Propanedioic acid, methylene-, cyclohexyl ethyl ester, homopolymer (9CI)
CAS Number:
149360-80-5
Molecular Formula:
C12H18O4
Molecular Weight:
226.2689
IUPAC Name:
1-O-cyclohexyl 3-O-ethyl 2-methylidenepropanedioate
InChI:
InChI=1S/C12H18O4/c1-3-15-11(13)9(2)12(14)16-10-7-5-4-6-8-10/h10H,2-8H2,1H3
InChI Key:
YMBZXNZJVMOFQV-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=C)C(=O)OC1CCCCC1
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.121g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.272g/mol
Monoisotopic Mass:
226.121g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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