Home Halogens 1-(6-chloropyrimidin-4-yl)-2,3-dihydro-1H-indole

1-(6-chloropyrimidin-4-yl)-2,3-dihydro-1H-indole

CAS No.:
293292-33-8
Catalog Number:
AG01ALLV
Molecular Formula:
C12H10ClN3
Molecular Weight:
231.6809
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Product Description
Catalog Number:
AG01ALLV
Chemical Name:
1-(6-chloropyrimidin-4-yl)-2,3-dihydro-1H-indole
CAS Number:
293292-33-8
Molecular Formula:
C12H10ClN3
Molecular Weight:
231.6809
MDL Number:
MFCD13561829
IUPAC Name:
1-(6-chloropyrimidin-4-yl)-2,3-dihydroindole
InChI:
InChI=1S/C12H10ClN3/c13-11-7-12(15-8-14-11)16-6-5-9-3-1-2-4-10(9)16/h1-4,7-8H,5-6H2
InChI Key:
RSEMHHFXNIKRQH-UHFFFAOYSA-N
SMILES:
Clc1ncnc(c1)N1CCc2c1cccc2
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.056g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.683g/mol
Monoisotopic Mass:
231.056g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties