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114184-98-4 | 1,2-Ethanediol, 1-(2-phenyl-1,3-dioxolan-4-yl)-
CAS No: 114184-98-4 Catalog No: AG000ARG MDL No:
Product Description
Catalog Number:
AG000ARG
Chemical Name:
1,2-Ethanediol, 1-(2-phenyl-1,3-dioxolan-4-yl)-
CAS Number:
114184-98-4
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
IUPAC Name:
1-(2-phenyl-1,3-dioxolan-4-yl)ethane-1,2-diol
InChI:
InChI=1S/C11H14O4/c12-6-9(13)10-7-14-11(15-10)8-4-2-1-3-5-8/h1-5,9-13H,6-7H2
InChI Key:
OIHSPKTUKHZNBY-UHFFFAOYSA-N
SMILES:
OCC(C1COC(O1)c1ccccc1)O
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.089g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
210.229g/mol
Monoisotopic Mass:
210.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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