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1263365-71-4 | 2-Bromo-3-(3-(Tetrahydro-pyran-2-yloxy)phenyl)-1-propene
CAS No: 1263365-71-4 Catalog No: AG01F7G9 MDL No:
Product Description
Catalog Number:
AG01F7G9
Chemical Name:
2-Bromo-3-(3-(Tetrahydro-pyran-2-yloxy)phenyl)-1-propene
CAS Number:
1263365-71-4
Molecular Formula:
C14H17BrO2
Molecular Weight:
297.1876
IUPAC Name:
2-[3-(2-bromoprop-2-enyl)phenoxy]oxane
InChI:
InChI=1S/C14H17BrO2/c1-11(15)9-12-5-4-6-13(10-12)17-14-7-2-3-8-16-14/h4-6,10,14H,1-3,7-9H2
InChI Key:
KLWJSMBKFMWXJZ-UHFFFAOYSA-N
SMILES:
BrC(=C)Cc1cccc(c1)OC1CCCCO1
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.041g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.192g/mol
Monoisotopic Mass:
296.041g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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