Home Carboxys 3-Iodo-1h-indazole-5-carboxylic acid methyl ester

3-Iodo-1h-indazole-5-carboxylic acid methyl ester

CAS No.:
885271-25-0
Catalog Number:
AG00473O
Molecular Formula:
C9H7IN2O2
Molecular Weight:
302.0686
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$52
- +
1g
97%
1 week
United States
$121
- +
5g
97%
1 week
United States
$409
- +
10g
97%
1 week
United States
$659
- +
Product Description
Catalog Number:
AG00473O
Chemical Name:
3-Iodo-1h-indazole-5-carboxylic acid methyl ester
CAS Number:
885271-25-0
Molecular Formula:
C9H7IN2O2
Molecular Weight:
302.0686
MDL Number:
MFCD06739144
IUPAC Name:
methyl 3-iodo-2H-indazole-5-carboxylate
InChI:
InChI=1S/C9H7IN2O2/c1-14-9(13)5-2-3-7-6(4-5)8(10)12-11-7/h2-4H,1H3,(H,11,12)
InChI Key:
JQHYEHRKSDHNFC-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1)c(I)n[nH]2
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.955g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
302.071g/mol
Monoisotopic Mass:
301.955g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties