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1249482-94-7 | 3-Bromobenzyl-(3-butene)ether
CAS No: 1249482-94-7 Catalog No: AG01FF5L MDL No:
Product Description
Catalog Number:
AG01FF5L
Chemical Name:
3-Bromobenzyl-(3-butene)ether
CAS Number:
1249482-94-7
Molecular Formula:
C11H13BrO
Molecular Weight:
241.1243
IUPAC Name:
1-bromo-3-(but-3-enoxymethyl)benzene
InChI:
InChI=1S/C11H13BrO/c1-2-3-7-13-9-10-5-4-6-11(12)8-10/h2,4-6,8H,1,3,7,9H2
InChI Key:
GVIOYNDGGGDLKD-UHFFFAOYSA-N
SMILES:
C=CCCOCc1cccc(c1)Br
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.015g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.128g/mol
Monoisotopic Mass:
240.015g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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