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88255-13-4 | Benzene, 1-(bromomethyl)-4-(undecyloxy)-
CAS No: 88255-13-4 Catalog No: AG004CGP MDL No:
Product Description
Catalog Number:
AG004CGP
Chemical Name:
Benzene, 1-(bromomethyl)-4-(undecyloxy)-
CAS Number:
88255-13-4
Molecular Formula:
C18H29BrO
Molecular Weight:
341.3263
IUPAC Name:
1-(bromomethyl)-4-undecoxybenzene
InChI:
InChI=1S/C18H29BrO/c1-2-3-4-5-6-7-8-9-10-15-20-18-13-11-17(16-19)12-14-18/h11-14H,2-10,15-16H2,1H3
InChI Key:
ZDOIOHCXBOCXTL-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCOc1ccc(cc1)CBr
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.14g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.333g/mol
Monoisotopic Mass:
340.14g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.6
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