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1135-70-2 | 1,3-Dioxolane-4-methanol, 2-ethyl-2-phenyl-
CAS No: 1135-70-2 Catalog No: AG0008S2 MDL No:
Product Description
Catalog Number:
AG0008S2
Chemical Name:
1,3-Dioxolane-4-methanol, 2-ethyl-2-phenyl-
CAS Number:
1135-70-2
Molecular Formula:
C12H16O3
Molecular Weight:
208.2536
IUPAC Name:
(2-ethyl-2-phenyl-1,3-dioxolan-4-yl)methanol
InChI:
InChI=1S/C12H16O3/c1-2-12(10-6-4-3-5-7-10)14-9-11(8-13)15-12/h3-7,11,13H,2,8-9H2,1H3
InChI Key:
MNDLRZFXJPXXCG-UHFFFAOYSA-N
SMILES:
OCC1COC(O1)(CC)c1ccccc1
NSC Number:
27568
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.11g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.257g/mol
Monoisotopic Mass:
208.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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