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159691-83-5 | 2H-Pyran, 2-[[2-(bromomethyl)-2-propen-1-yl]oxy]tetrahydro-
CAS No: 159691-83-5 Catalog No: AG001RBA MDL No:
Product Description
Catalog Number:
AG001RBA
Chemical Name:
2H-Pyran, 2-[[2-(bromomethyl)-2-propen-1-yl]oxy]tetrahydro-
CAS Number:
159691-83-5
Molecular Formula:
C9H15BrO2
Molecular Weight:
235.1182
IUPAC Name:
2-[2-(bromomethyl)prop-2-enoxy]oxane
InChI:
InChI=1S/C9H15BrO2/c1-8(6-10)7-12-9-4-2-3-5-11-9/h9H,1-7H2
InChI Key:
JMASQQWMAMICKB-UHFFFAOYSA-N
SMILES:
BrCC(=C)COC1CCCCO1
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.026g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.121g/mol
Monoisotopic Mass:
234.026g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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