Home Halogens 2-{3-bromo-5H,6H,7H,8H-imidazo[1,5-a]pyridin-7-yl}acetic acid

2-{3-bromo-5H,6H,7H,8H-imidazo[1,5-a]pyridin-7-yl}acetic acid

CAS No.:
1781693-09-1
Catalog Number:
AG01ELFL
Molecular Formula:
C9H11BrN2O2
Molecular Weight:
259.0998
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01ELFL
Chemical Name:
2-{3-bromo-5H,6H,7H,8H-imidazo[1,5-a]pyridin-7-yl}acetic acid
CAS Number:
1781693-09-1
Molecular Formula:
C9H11BrN2O2
Molecular Weight:
259.0998
MDL Number:
MFCD31691139
IUPAC Name:
2-(3-bromo-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-7-yl)acetic acid
InChI:
InChI=1S/C9H11BrN2O2/c10-9-11-5-7-3-6(4-8(13)14)1-2-12(7)9/h5-6H,1-4H2,(H,13,14)
InChI Key:
JTHWHWCHRFODNW-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CCn2c(C1)cnc2Br
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
259.103g/mol
Monoisotopic Mass:
258g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties