200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1167418-10-1
1167418-10-1 | 1H-Indazole-1-carboxylic acid, 5-fluoro-, 1,1-dimethylethyl ester
CAS No: 1167418-10-1 Catalog No: AG000D5T MDL No:
Product Description
Catalog Number:
AG000D5T
Chemical Name:
1H-Indazole-1-carboxylic acid, 5-fluoro-, 1,1-dimethylethyl ester
CAS Number:
1167418-10-1
Molecular Formula:
C12H13FN2O2
Molecular Weight:
236.2422
IUPAC Name:
tert-butyl 5-fluoroindazole-1-carboxylate
InChI:
InChI=1S/C12H13FN2O2/c1-12(2,3)17-11(16)15-10-5-4-9(13)6-8(10)7-14-15/h4-7H,1-3H3
InChI Key:
IEGABWOPJJSVIH-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)cnn2C(=O)OC(C)(C)C
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.096g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.246g/mol
Monoisotopic Mass:
236.096g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.