1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

7-bromo-4-methoxy-1H-pyrrolo[2,3-c]pyridine

2.1.2 InChI

InChI=1S/C8H7BrN2O/c1-12-6-4-11-8(9)7-5(6)2-3-10-7/h2-4,10H,1H3

2.1.3 InChI Key

SSEKUWDRHZZSFH-UHFFFAOYSA-N

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 619331-35-0

2. 1h-pyrrolo[2,3-c]pyridine, 7-bromo-4-methoxy-

3. 4-methoxy-7-bromo-6-azaindole

4. 7-bromo-4-methoxy-6-azaindole

5. Mfcd12756855

6. Schembl1472560

7. Schembl28728954

8. Ssekuwdrhzzsfh-uhfffaoysa-n

9. Zb0759

10. Sb13353

11. Bs-51750

12. Da-35769

13. Cs-0160480

14. C91308

2.3 Create Date

2007-12-05

3 Chemical and Physical Properties

Molecular Formula	C₈H₇BrN₂O
Molecular Weight	227.06 g/mol
XLogP3	2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	Da
Monoisotopic Mass	Da
Topological Polar Surface Area	37.9
Heavy Atom Count	12
Formal Charge	0
Complexity	167
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

CAS 619331-35-0