Home Aldehydes 3-Iodo-1H-indazole-5-carbaldehyde

3-Iodo-1H-indazole-5-carbaldehyde

CAS No.:
944899-01-8
Catalog Number:
AG00II8E
Molecular Formula:
C8H5IN2O
Molecular Weight:
272.0426
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00II8E
Chemical Name:
3-Iodo-1H-indazole-5-carbaldehyde
CAS Number:
944899-01-8
Molecular Formula:
C8H5IN2O
Molecular Weight:
272.0426
IUPAC Name:
3-iodo-2H-indazole-5-carbaldehyde
InChI:
InChI=1S/C8H5IN2O/c9-8-6-3-5(4-12)1-2-7(6)10-11-8/h1-4H,(H,10,11)
InChI Key:
STUWJSRMOZCBIX-UHFFFAOYSA-N
SMILES:
Ic1n[nH]c2c1cc(C=O)cc2
Properties
Complexity:
188  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.945g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
272.045g/mol
Monoisotopic Mass:
271.945g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties