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103987-79-7 | 5-Ethynylquinoline
CAS No: 103987-79-7 Catalog No: AG0096WF MDL No:MFCD07644616
Product Description
Catalog Number:
AG0096WF
Chemical Name:
5-Ethynylquinoline
CAS Number:
103987-79-7
Molecular Formula:
C11H7N
Molecular Weight:
153.1800
MDL Number:
MFCD07644616
IUPAC Name:
5-ethynylquinoline
InChI:
InChI=1S/C11H7N/c1-2-9-5-3-7-11-10(9)6-4-8-12-11/h1,3-8H
InChI Key:
GFTBWCMHAKTOJY-UHFFFAOYSA-N
SMILES:
C#Cc1cccc2c1cccn2
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.058g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.184g/mol
Monoisotopic Mass:
153.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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