200,000+ products from a single source!
sales@angenechem.com
Home > Quinoline > 1306606-16-5
1306606-16-5 | 2-(1H-pyrazol-4-yl)-1,2,3,4-tetrahydroquinoline
CAS No: 1306606-16-5 Catalog No: AG01AIG0 MDL No:MFCD18839064
Product Description
Catalog Number:
AG01AIG0
Chemical Name:
2-(1H-pyrazol-4-yl)-1,2,3,4-tetrahydroquinoline
CAS Number:
1306606-16-5
Molecular Formula:
C12H13N3
Molecular Weight:
199.2517
MDL Number:
MFCD18839064
IUPAC Name:
2-(1H-pyrazol-4-yl)-1,2,3,4-tetrahydroquinoline
InChI:
InChI=1S/C12H13N3/c1-2-4-11-9(3-1)5-6-12(15-11)10-7-13-14-8-10/h1-4,7-8,12,15H,5-6H2,(H,13,14)
InChI Key:
PKJBZGLJKAYQKE-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)NC(CC2)c1c[nH]nc1
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
199.257g/mol
Monoisotopic Mass:
199.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.