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20614-18-0 | Peroxide, 1-chloroethyl 1,1-dimethylethyl
CAS No: 20614-18-0 Catalog No: AG002AJM MDL No:
Product Description
Catalog Number:
AG002AJM
Chemical Name:
Peroxide, 1-chloroethyl 1,1-dimethylethyl
CAS Number:
20614-18-0
Molecular Formula:
C6H13ClO2
Molecular Weight:
152.6192
IUPAC Name:
2-(1-chloroethylperoxy)-2-methylpropane
InChI:
InChI=1S/C6H13ClO2/c1-5(7)8-9-6(2,3)4/h5H,1-4H3
InChI Key:
GVLVJJPXDKREPH-UHFFFAOYSA-N
SMILES:
CC(OOC(C)(C)C)Cl
Properties
Complexity:
77.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.06g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.618g/mol
Monoisotopic Mass:
152.06g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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