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13657-49-3 | Benzene, 1,1'-(2-butene-1,4-diyl)bis-
CAS No: 13657-49-3 Catalog No: AG00123C MDL No:
Product Description
Catalog Number:
AG00123C
Chemical Name:
Benzene, 1,1'-(2-butene-1,4-diyl)bis-
CAS Number:
13657-49-3
Molecular Formula:
C16H16
Molecular Weight:
208.2982
IUPAC Name:
4-phenylbut-2-enylbenzene
InChI:
InChI=1S/C16H16/c1-3-9-15(10-4-1)13-7-8-14-16-11-5-2-6-12-16/h1-12H,13-14H2
InChI Key:
CTYOBVWQEXIGRQ-UHFFFAOYSA-N
SMILES:
C(=CCc1ccccc1)Cc1ccccc1
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.125g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.304g/mol
Monoisotopic Mass:
208.125g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.8
Literature
| Title | Journal |
|---|---|
| Structure of the human mitochondrial monoamine oxidase B: new chemical implications for neuroprotectant drug design. | Neurology 20061010 |
| Demonstration of isoleucine 199 as a structural determinant for the selective inhibition of human monoamine oxidase B by specific reversible inhibitors. | The Journal of biological chemistry 20050422 |
| Polystyrene microbridges used in sitting-drop crystallization release 1,4-diphenyl-2-butene, a novel inhibitor of human MAO B. | Acta crystallographica. Section D, Biological crystallography 20031001 |
| Formation of cyclopentadienyl and ruthenacyclopentadienyl derivatives through ynenyl-diyne and ynenyl-alkyne couplings onto a triruthenium cluster core. | Chemistry (Weinheim an der Bergstrasse, Germany) 20010601 |
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