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Home Carboxys 3-Bromo-7-azaindole-5-carboxylic acid methyl ester

3-Bromo-7-azaindole-5-carboxylic acid methyl ester

CAS No.:
1190322-65-6
Catalog Number:
AG000I2S
Molecular Formula:
C9H7BrN2O2
Molecular Weight:
255.0681
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$239
- +
5g
97%
1 week
United States
$644
- +
10g
97%
1 week
United States
$1048
- +
Product Description
Catalog Number:
AG000I2S
Chemical Name:
3-Bromo-7-azaindole-5-carboxylic acid methyl ester
CAS Number:
1190322-65-6
Molecular Formula:
C9H7BrN2O2
Molecular Weight:
255.0681
MDL Number:
MFCD12962903
IUPAC Name:
methyl 3-bromo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate
InChI:
InChI=1S/C9H7BrN2O2/c1-14-9(13)5-2-6-7(10)4-12-8(6)11-3-5/h2-4H,1H3,(H,11,12)
InChI Key:
ANVCBIHBYSCXGR-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc2c(Br)c[nH]c2nc1
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.969g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
255.071g/mol
Monoisotopic Mass:
253.969g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties