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103987-80-0 | 7-Ethynylquinoline
CAS No: 103987-80-0 Catalog No: AG00855Z MDL No:MFCD18802508
Product Description
Catalog Number:
AG00855Z
Chemical Name:
7-Ethynylquinoline
CAS Number:
103987-80-0
Molecular Formula:
C11H7N
Molecular Weight:
153.1800
MDL Number:
MFCD18802508
IUPAC Name:
7-ethynylquinoline
InChI:
InChI=1S/C11H7N/c1-2-9-5-6-10-4-3-7-12-11(10)8-9/h1,3-8H
InChI Key:
TYEQAXHHXXPDJP-UHFFFAOYSA-N
SMILES:
C#Cc1ccc2c(c1)nccc2
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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