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207795-40-2 | Benzene, 1-[[(10-bromodecyl)oxy]methyl]-4-methoxy-
CAS No: 207795-40-2 Catalog No: AG002J9W MDL No:
Product Description
Catalog Number:
AG002J9W
Chemical Name:
Benzene, 1-[[(10-bromodecyl)oxy]methyl]-4-methoxy-
CAS Number:
207795-40-2
Molecular Formula:
C18H29BrO2
Molecular Weight:
357.3257
IUPAC Name:
1-(10-bromodecoxymethyl)-4-methoxybenzene
InChI:
InChI=1S/C18H29BrO2/c1-20-18-12-10-17(11-13-18)16-21-15-9-7-5-3-2-4-6-8-14-19/h10-13H,2-9,14-16H2,1H3
InChI Key:
RXEOAYVMHFYQNJ-UHFFFAOYSA-N
SMILES:
BrCCCCCCCCCCOCc1ccc(cc1)OC
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
356.135g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
357.332g/mol
Monoisotopic Mass:
356.135g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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