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1020719-26-9 | Benzene, 1-(2-chloroethoxy)-4-[1-[4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]phenyl]-2-phenyl-1-buten-1-yl-3,3,4,4,4-d5]-
CAS No: 1020719-26-9 Catalog No: AG0006JQ MDL No:
Product Description
Catalog Number:
AG0006JQ
Chemical Name:
Benzene, 1-(2-chloroethoxy)-4-[1-[4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]phenyl]-2-phenyl-1-buten-1-yl-3,3,4,4,4-d5]-
CAS Number:
1020719-26-9
Molecular Formula:
C30H32ClD5O2Si
Molecular Weight:
498.1829
IUPAC Name:
tert-butyl-[4-[1-[4-(2-chloroethoxy)phenyl]-3,3,4,4,4-pentadeuterio-2-phenylbut-1-enyl]phenoxy]-dimethylsilane
InChI:
InChI=1S/C30H37ClO2Si/c1-7-28(23-11-9-8-10-12-23)29(24-13-17-26(18-14-24)32-22-21-31)25-15-19-27(20-16-25)33-34(5,6)30(2,3)4/h8-20H,7,21-22H2,1-6H3/i1D3,7D2
InChI Key:
ODAPRONGKJOXCU-WRMAMSRYSA-N
SMILES:
ClCCOc1ccc(cc1)C(=C(C(C([2H])([2H])[2H])([2H])[2H])c1ccccc1)c1ccc(cc1)O[Si](C(C)(C)C)(C)C
Properties
Complexity:
631
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
497.257g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
5
Molecular Weight:
498.19g/mol
Monoisotopic Mass:
497.257g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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