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Home > Bromides > 1309935-85-0
1309935-85-0 | 3-Bromobenzyl-(cis-2-pentenyl)ether
CAS No: 1309935-85-0 Catalog No: AG01FDV6 MDL No:
Product Description
Catalog Number:
AG01FDV6
Chemical Name:
3-Bromobenzyl-(cis-2-pentenyl)ether
CAS Number:
1309935-85-0
Molecular Formula:
C12H15BrO
Molecular Weight:
255.1509
IUPAC Name:
1-bromo-3-[[(Z)-pent-2-enoxy]methyl]benzene
InChI:
InChI=1S/C12H15BrO/c1-2-3-4-8-14-10-11-6-5-7-12(13)9-11/h3-7,9H,2,8,10H2,1H3/b4-3-
InChI Key:
NCQRQTXVUAVMBN-ARJAWSKDSA-N
SMILES:
CC/C=C\COCc1cccc(c1)Br
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
254.031g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.155g/mol
Monoisotopic Mass:
254.031g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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