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17694-87-0 | Naphthalene, 1,8-bis(2-phenylethynyl)-
CAS No: 17694-87-0 Catalog No: AG00250H MDL No:
Product Description
Catalog Number:
AG00250H
Chemical Name:
Naphthalene, 1,8-bis(2-phenylethynyl)-
CAS Number:
17694-87-0
Molecular Formula:
C26H16
Molecular Weight:
328.4052
IUPAC Name:
1,8-bis(2-phenylethynyl)naphthalene
InChI:
InChI=1S/C26H16/c1-3-9-21(10-4-1)17-19-24-15-7-13-23-14-8-16-25(26(23)24)20-18-22-11-5-2-6-12-22/h1-16H
InChI Key:
VUWXIJSTGVLREH-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C#Cc1cccc2c1c(ccc2)C#Cc1ccccc1
Properties
Complexity:
523
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.125g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.414g/mol
Monoisotopic Mass:
328.125g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2
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