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29568-65-8 | 1,3-Dioxolane, 2-(1-bromoethyl)-2-phenyl-
CAS No: 29568-65-8 Catalog No: AG002YRV MDL No:
Product Description
Catalog Number:
AG002YRV
Chemical Name:
1,3-Dioxolane, 2-(1-bromoethyl)-2-phenyl-
CAS Number:
29568-65-8
Molecular Formula:
C11H13BrO2
Molecular Weight:
257.1237
IUPAC Name:
2-(1-bromoethyl)-2-phenyl-1,3-dioxolane
InChI:
InChI=1S/C11H13BrO2/c1-9(12)11(13-7-8-14-11)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3
InChI Key:
XVCCETUPKGWPKC-UHFFFAOYSA-N
SMILES:
CC(C1(OCCO1)c1ccccc1)Br
NSC Number:
142324
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.01g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.127g/mol
Monoisotopic Mass:
256.01g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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