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1000340-37-3,MFCD09880128
Catalog No.:AA0000B5
1000340-37-3 | 1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 4-chloro-
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1g
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1 week  
$169.00
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0000B5
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-3-carboxylic acid, 4-chloro-
CAS Number:
1000340-37-3
Molecular Formula:
C8H5ClN2O2
Molecular Weight:
196.5905
MDL Number:
MFCD09880128
IUPAC Name:
4-chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid
InChI:
InChI=1S/C8H5ClN2O2/c9-5-1-2-10-7-6(5)4(3-11-7)8(12)13/h1-3H,(H,10,11)(H,12,13)
InChI Key:
CFASASVVIOZGNK-UHFFFAOYSA-N
SMILES:
OC(=O)c1c[nH]c2c1c(Cl)ccn2
Properties
Computed Properties
 
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.004g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
196.59g/mol
Monoisotopic Mass:
196.004g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

Synonyms
 
4-CHLORO-1H-PYRROLO[2,3-B]PYRIDINE-3-CARBOXYLIC ACID 
1000340-37-3 
ZINC19046167 
AKOS006313300 
CC-2182 
PB29740 
RP25469 
KS-0000039K 
AJ-70787 
AS-33553 
QC-10241 
AB0098039 
4-Chloro-7-azaindole-3-carboxylic acid 
DB-058218 
ST1090512 
TC-143480 
CS-0050946 
FT-0646828 
Q-2186 
4-Chloro-7-azaindole-3-carboxylic acid, AldrichCPR 
J-514888 
(4-Chloro-1H-pyrrolo2,3-bpyridin-3-yl)-acetic acid 
1H-Pyrrolo[2,3-b]pyridine-3-carboxylicacid, 4-chloro- 
SCHEMBL17818839 
2-(4-CHLORO-1H-PYRROLO[2,3-B]PYRIDIN-3-YL)ACETIC ACID 
CTK0G9203 
DTXSID40646885 
CFASASVVIOZGNK-UHFFFAOYSA-N 
1H-PYRROLO[2,3-B]PYRIDINE-3-CARBOXYLIC ACID, 4-CHLORO- 
ANW-54735 
MFCD09880128 
Literature
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