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Home > Pyridines > 189190-29-2
189190-29-2 | Pyridine, 4-[2-(4-ethynylphenyl)ethynyl]-
CAS No: 189190-29-2 Catalog No: AG002I0R MDL No:
Product Description
Catalog Number:
AG002I0R
Chemical Name:
Pyridine, 4-[2-(4-ethynylphenyl)ethynyl]-
CAS Number:
189190-29-2
Molecular Formula:
C15H9N
Molecular Weight:
203.2387
IUPAC Name:
4-[2-(4-ethynylphenyl)ethynyl]pyridine
InChI:
InChI=1S/C15H9N/c1-2-13-3-5-14(6-4-13)7-8-15-9-11-16-12-10-15/h1,3-6,9-12H
InChI Key:
QEUHXPTXFCCCBW-UHFFFAOYSA-N
SMILES:
C#Cc1ccc(cc1)C#Cc1ccncc1
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.073g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.244g/mol
Monoisotopic Mass:
203.073g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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