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Home Halogens 3-Iodo-5-chloro-(1h)indazole-6-carboxylic methyl ester

3-Iodo-5-chloro-(1h)indazole-6-carboxylic methyl ester

CAS No.:
1227270-79-2
Catalog Number:
AG000J72
Molecular Formula:
C9H6ClIN2O2
Molecular Weight:
336.5136
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$263
- +
250mg
95%
In Stock USA
United States
$413
- +
1g
95%
In Stock USA
United States
$1025
- +
Product Description
Catalog Number:
AG000J72
Chemical Name:
3-Iodo-5-chloro-(1h)indazole-6-carboxylic methyl ester
CAS Number:
1227270-79-2
Molecular Formula:
C9H6ClIN2O2
Molecular Weight:
336.5136
MDL Number:
MFCD16875822
IUPAC Name:
methyl 5-chloro-3-iodo-2H-indazole-6-carboxylate
InChI:
InChI=1S/C9H6ClIN2O2/c1-15-9(14)4-3-7-5(2-6(4)10)8(11)13-12-7/h2-3H,1H3,(H,12,13)
InChI Key:
MNBVUYGQRIXKAI-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc2[nH]nc(c2cc1Cl)I
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.916g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
336.513g/mol
Monoisotopic Mass:
335.916g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties