200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1234616-33-1
1234616-33-1 | 1H-Indazole-5-carboxylic acid, 3-iodo-1-methyl-
CAS No: 1234616-33-1 Catalog No: AG000KMC MDL No:MFCD15071441
Product Description
Catalog Number:
AG000KMC
Chemical Name:
1H-Indazole-5-carboxylic acid, 3-iodo-1-methyl-
CAS Number:
1234616-33-1
Molecular Formula:
C9H7IN2O2
Molecular Weight:
302.0686
MDL Number:
MFCD15071441
IUPAC Name:
3-iodo-1-methylindazole-5-carboxylic acid
InChI:
InChI=1S/C9H7IN2O2/c1-12-7-3-2-5(9(13)14)4-6(7)8(10)11-12/h2-4H,1H3,(H,13,14)
InChI Key:
STFILDDHMDTELI-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1)c(I)nn2C
Properties
Complexity:
249
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:
1
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.