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85005-57-8 | Isononyl methacrylate
CAS No: 85005-57-8 Catalog No: AG004TSH MDL No:
Product Description
Catalog Number:
AG004TSH
Chemical Name:
Isononyl methacrylate
CAS Number:
85005-57-8
Molecular Formula:
C13H24O2
Molecular Weight:
212.3285
IUPAC Name:
7-methyloctyl 2-methylprop-2-enoate
InChI:
InChI=1S/C13H24O2/c1-11(2)9-7-5-6-8-10-15-13(14)12(3)4/h11H,3,5-10H2,1-2,4H3
InChI Key:
XFZOHDFQOOTHRH-UHFFFAOYSA-N
SMILES:
CC(CCCCCCOC(=O)C(=C)C)C
EC Number:
284-989-6
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.178g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.333g/mol
Monoisotopic Mass:
212.178g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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