200,000+ products from a single source!
sales@angenechem.com
Home > Carboxes > 1649470-12-1
1649470-12-1 | 1H-Pyrrolo[3,2-c]pyridine-1-carboxylic acid, 6-chloro-2,3-dihydro-, 1,1-dimethylethyl ester
CAS No: 1649470-12-1 Catalog No: AG001V6E MDL No:
Product Description
Catalog Number:
AG001V6E
Chemical Name:
1H-Pyrrolo[3,2-c]pyridine-1-carboxylic acid, 6-chloro-2,3-dihydro-, 1,1-dimethylethyl ester
CAS Number:
1649470-12-1
Molecular Formula:
C12H15ClN2O2
Molecular Weight:
254.7127
IUPAC Name:
tert-butyl 6-chloro-2,3-dihydropyrrolo[3,2-c]pyridine-1-carboxylate
InChI:
InChI=1S/C12H15ClN2O2/c1-12(2,3)17-11(16)15-5-4-8-7-14-10(13)6-9(8)15/h6-7H,4-5H2,1-3H3
InChI Key:
FUDBNGZQHOMXHH-UHFFFAOYSA-N
SMILES:
O=C(N1CCc2c1cc(Cl)nc2)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:
254.082g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.714g/mol
Monoisotopic Mass:
254.082g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.