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1239668-68-8 | 2-Bromobenzyl-(3-butene)ether
CAS No: 1239668-68-8 Catalog No: AG01FF5I MDL No:
Product Description
Catalog Number:
AG01FF5I
Chemical Name:
2-Bromobenzyl-(3-butene)ether
CAS Number:
1239668-68-8
Molecular Formula:
C11H13BrO
Molecular Weight:
241.1243
IUPAC Name:
1-bromo-2-(but-3-enoxymethyl)benzene
InChI:
InChI=1S/C11H13BrO/c1-2-3-8-13-9-10-6-4-5-7-11(10)12/h2,4-7H,1,3,8-9H2
InChI Key:
FEFIQUQEZQLAOJ-UHFFFAOYSA-N
SMILES:
C=CCCOCc1ccccc1Br
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:
3.4
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