200,000+ products from a single source!
sales@angenechem.com
Home > Bromides > 1190322-65-6
1190322-65-6 | 1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 3-bromo-, methyl ester
CAS No: 1190322-65-6 Catalog No: AG000I2S MDL No:MFCD12962903
Product Description
Catalog Number:
AG000I2S
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 3-bromo-, 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
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.