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10027-71-1 | Hydroperoxide, methoxyphenylmethyl
CAS No: 10027-71-1 Catalog No: AG0001FS MDL No:
Product Description
Catalog Number:
AG0001FS
Chemical Name:
Hydroperoxide, methoxyphenylmethyl
CAS Number:
10027-71-1
Molecular Formula:
C8H10O3
Molecular Weight:
154.1632
IUPAC Name:
[hydroperoxy(methoxy)methyl]benzene
InChI:
InChI=1S/C8H10O3/c1-10-8(11-9)7-5-3-2-4-6-7/h2-6,8-9H,1H3
InChI Key:
HYCZIVPUCFACJA-UHFFFAOYSA-N
SMILES:
COC(c1ccccc1)OO
Properties
Complexity:
99.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.063g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.165g/mol
Monoisotopic Mass:
154.063g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| On-line analysis of a continuous-flow ozonolysis reaction using Raman spectroscopy. | Applied spectroscopy 20071001 |
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