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114012-43-0 | 3-Oxetanemethanol, 3-phenyl-
CAS No: 114012-43-0 Catalog No: AG000AAA MDL No:MFCD18642402
Product Description
Catalog Number:
AG000AAA
Chemical Name:
3-Oxetanemethanol, 3-phenyl-
CAS Number:
114012-43-0
Molecular Formula:
C10H12O2
Molecular Weight:
164.2011
MDL Number:
MFCD18642402
IUPAC Name:
(3-phenyloxetan-3-yl)methanol
InChI:
InChI=1S/C10H12O2/c11-6-10(7-12-8-10)9-4-2-1-3-5-9/h1-5,11H,6-8H2
InChI Key:
MDFSDDCPPNQIFV-UHFFFAOYSA-N
SMILES:
OCC1(COC1)c1ccccc1
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.204g/mol
Monoisotopic Mass:
164.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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