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2653-40-9 | Oxirane, 2-[[2-(1-methylethenyl)phenoxy]methyl]-
CAS No: 2653-40-9 Catalog No: AG002TKN MDL No:
Product Description
Catalog Number:
AG002TKN
Chemical Name:
Oxirane, 2-[[2-(1-methylethenyl)phenoxy]methyl]-
CAS Number:
2653-40-9
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
IUPAC Name:
2-[(2-prop-1-en-2-ylphenoxy)methyl]oxirane
InChI:
InChI=1S/C12H14O2/c1-9(2)11-5-3-4-6-12(11)14-8-10-7-13-10/h3-6,10H,1,7-8H2,2H3
InChI Key:
DQJPVGLHHIGXJL-UHFFFAOYSA-N
SMILES:
CC(=C)c1ccccc1OCC1CO1
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.099g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.242g/mol
Monoisotopic Mass:
190.099g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
21.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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