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17628-72-7 | Benzeneethanol, β-methoxy-, (βR)-
CAS No: 17628-72-7 Catalog No: AG0024JJ MDL No:MFCD00011550
Product Description
Catalog Number:
AG0024JJ
Chemical Name:
Benzeneethanol, β-methoxy-, (βR)-
CAS Number:
17628-72-7
Molecular Formula:
C9H12O2
Molecular Weight:
152.1904
MDL Number:
MFCD00011550
IUPAC Name:
(2R)-2-methoxy-2-phenylethanol
InChI:
InChI=1S/C9H12O2/c1-11-9(7-10)8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3/t9-/m0/s1
InChI Key:
JDTUPLBMGDDPJS-VIFPVBQESA-N
SMILES:
OC[C@@H](c1ccccc1)OC
Properties
Complexity:
97.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
152.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
152.193g/mol
Monoisotopic Mass:
152.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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