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26447-45-0 | Oxirane, 2-[[(1,1-dimethylethyl)phenoxy]methyl]-
CAS No: 26447-45-0 Catalog No: AG002T8M MDL No:
Product Description
Catalog Number:
AG002T8M
Chemical Name:
Oxirane, 2-[[(1,1-dimethylethyl)phenoxy]methyl]-
CAS Number:
26447-45-0
Molecular Formula:
C13H18O2
Molecular Weight:
206.2808
IUPAC Name:
2-[(2-tert-butylphenoxy)methyl]oxirane
InChI:
InChI=1S/C13H18O2/c1-13(2,3)11-6-4-5-7-12(11)15-9-10-8-14-10/h4-7,10H,8-9H2,1-3H3
InChI Key:
UZYFEQIMORYGRW-UHFFFAOYSA-N
SMILES:
CC(c1ccccc1OCC1CO1)(C)C
EC Number:
255-081-7
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.131g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.285g/mol
Monoisotopic Mass:
206.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
21.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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