Home Halogens Benzene, 1,3-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-5-(bromomethyl)-

Benzene, 1,3-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-5-(bromomethyl)-

CAS No.:
137472-17-4
Catalog Number:
AG0013C3
Molecular Formula:
C105H91BrO14
Molecular Weight:
1656.7416
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Product Description
Catalog Number:
AG0013C3
Chemical Name:
Benzene, 1,3-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-5-(bromomethyl)-
CAS Number:
137472-17-4
Molecular Formula:
C105H91BrO14
Molecular Weight:
1656.7416
IUPAC Name:
1,3-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]-5-(bromomethyl)benzene
InChI:
InChI=1S/C105H91BrO14/c106-62-85-41-92(115-71-90-51-102(117-73-86-43-94(107-63-77-25-9-1-10-26-77)56-95(44-86)108-64-78-27-11-2-12-28-78)60-103(52-90)118-74-87-45-96(109-65-79-29-13-3-14-30-79)57-97(46-87)110-66-80-31-15-4-16-32-80)55-93(42-85)116-72-91-53-104(119-75-88-47-98(111-67-81-33-17-5-18-34-81)58-99(48-88)112-68-82-35-19-6-20-36-82)61-105(54-91)120-76-89-49-100(113-69-83-37-21-7-22-38-83)59-101(50-89)114-70-84-39-23-8-24-40-84/h1-61H,62-76H2
InChI Key:
ZCZKYSOONGSDFE-UHFFFAOYSA-N
SMILES:
BrCc1cc(OCc2cc(OCc3cc(OCc4ccccc4)cc(c3)OCc3ccccc3)cc(c2)OCc2cc(OCc3ccccc3)cc(c2)OCc2ccccc2)cc(c1)OCc1cc(OCc2cc(OCc3ccccc3)cc(c2)OCc2ccccc2)cc(c1)OCc1cc(OCc2ccccc2)cc(c1)OCc1ccccc1
Properties
Complexity:
2220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
1655.563g/mol
Formal Charge:
0
Heavy Atom Count:
120  
Hydrogen Bond Acceptor Count:
14  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
1656.773g/mol
Monoisotopic Mass:
1654.559g/mol
Rotatable Bond Count:
43  
Topological Polar Surface Area:
129A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
23  
Properties