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136528-28-4 | 2-Propenoic acid, 2-[[(1,1-dimethylethyl)dioxy]methyl]-, ethyl ester
CAS No: 136528-28-4 Catalog No: AG00121Y MDL No:
Product Description
Catalog Number:
AG00121Y
Chemical Name:
2-Propenoic acid, 2-[[(1,1-dimethylethyl)dioxy]methyl]-, ethyl ester
CAS Number:
136528-28-4
Molecular Formula:
C10H18O4
Molecular Weight:
202.2475
IUPAC Name:
ethyl 2-(tert-butylperoxymethyl)prop-2-enoate
InChI:
InChI=1S/C10H18O4/c1-6-12-9(11)8(2)7-13-14-10(3,4)5/h2,6-7H2,1,3-5H3
InChI Key:
SWGSQYVGWUFKFA-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=C)COOC(C)(C)C
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.121g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.25g/mol
Monoisotopic Mass:
202.121g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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