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113488-11-2 | 2-Butenedinitrile, 2,3-bis[2-[2-(methylseleno)phenyl]-2-phenylethenyl]-
CAS No: 113488-11-2 Catalog No: AG0008QW MDL No:
Product Description
Catalog Number:
AG0008QW
Chemical Name:
2-Butenedinitrile, 2,3-bis[2-[2-(methylseleno)phenyl]-2-phenylethenyl]-
CAS Number:
113488-11-2
Molecular Formula:
C34H26N2Se2
Molecular Weight:
620.5036
IUPAC Name:
2,3-bis[2-(2-methylselanylphenyl)-2-phenylethenyl]but-2-enedinitrile
InChI:
InChI=1S/C34H26N2Se2/c1-37-33-19-11-9-17-29(33)31(25-13-5-3-6-14-25)21-27(23-35)28(24-36)22-32(26-15-7-4-8-16-26)30-18-10-12-20-34(30)38-2/h3-22H,1-2H3
InChI Key:
STUPCFCDNVVABE-UHFFFAOYSA-N
SMILES:
N#CC(=C(C=C(c1ccccc1[Se]C)c1ccccc1)C#N)C=C(c1ccccc1[Se]C)c1ccccc1
Properties
Complexity:
883
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
622.043g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
620.538g/mol
Monoisotopic Mass:
622.043g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
3
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