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114402-11-8,MFCD09035048
Catalog No.:AA000B6K
114402-11-8 | 6,7-Dihydro-5H-cyclopenta[b]pyridine-3-carboxylic acid
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Purity
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Price(USD)
Quantity
  
100mg
95%
2 weeks  
$275.00   $193.00
- +
250mg
95%
2 weeks  
$402.00   $282.00
- +
1g
95%
2 weeks  
$1,330.00   $931.00
- +
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Technical Information
Catalog Number:
AA000B6K
Chemical Name:
6,7-Dihydro-5H-cyclopenta[b]pyridine-3-carboxylic acid
CAS Number:
114402-11-8
Molecular Formula:
C9H9NO2
Molecular Weight:
163.1733
MDL Number:
MFCD09035048
IUPAC Name:
6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxylic acid
InChI:
InChI=1S/C9H9NO2/c11-9(12)7-4-6-2-1-3-8(6)10-5-7/h4-5H,1-3H2,(H,11,12)
InChI Key:
KDCDSNYNWQNPRU-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc2c(c1)CCC2
Properties
Computed Properties
 
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.063g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
163.176g/mol
Monoisotopic Mass:
163.063g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

Synonyms
 
6,7-Dihydro-5H-cyclopenta[b]pyridine-3-carboxylic acid 
113124-12-2 
AX8280953 
Y-4804 
S14-2028 
5H,6H,7H-CYCLOPENTA[B]PYRIDINE-3-CARBOXYLIC ACID 
5H-Cyclopenta[b]pyridine-3-carboxylic acid, 6,7-dihydro- 
6,7-Dihydro-5H-cyclopenta[b]pyridine-3-carboxylic acid, AldrichCPR 
114402-11-8 
SCHEMBL2729684 
ZX-CM014982 
FCH832634 
MFCD09035048 
ZINC20441996 
AKOS004121014 
AJ-77625 
Literature
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