Home Quinolines 1015070-57-1
1015070-57-1,MFCD12406191
Catalog No.:AA0004KJ
1015070-57-1 | 6-Ethynylisoquinoline
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95+%
2 weeks  
$83.00   $58.00
- +
1g
98%
2 weeks  
$110.00   $77.00
- +
5g
98%
2 weeks  
$209.00   $146.00
- +
  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA0004KJ
Chemical Name:
6-Ethynylisoquinoline
CAS Number:
1015070-57-1
Molecular Formula:
C11H7N
Molecular Weight:
153.1800
MDL Number:
MFCD12406191
IUPAC Name:
6-ethynylisoquinoline
InChI:
InChI=1S/C11H7N/c1-2-9-3-4-11-8-12-6-5-10(11)7-9/h1,3-8H
InChI Key:
ULAVHAJIBKHAPF-UHFFFAOYSA-N
SMILES:
C#Cc1ccc2c(c1)ccnc2
Properties
Computed 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:
2.3  

Synonyms
 
6-Ethynylisoquinoline 
1015070-57-1 
AJ-124543 
TC-158527 
ST24024381 
Y5143 
A1-02128 
C11H7N 
Isoquinoline, 6-ethynyl- 
SCHEMBL1519614 
CTK8C3182 
DTXSID00728454 
ULAVHAJIBKHAPF-UHFFFAOYSA-N 
ANW-69782 
ZINC82046848 
AKOS016001963 
Literature
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