Home Halogens 1-(2-chloro-5-fluoropyrimidin-4-yl)pyrrolidin-3-amine

1-(2-chloro-5-fluoropyrimidin-4-yl)pyrrolidin-3-amine

CAS No.:
1310558-47-4
Catalog Number:
AG01ELA2
Molecular Formula:
C8H10ClFN4
Molecular Weight:
216.6432
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Product Description
Catalog Number:
AG01ELA2
Chemical Name:
1-(2-chloro-5-fluoropyrimidin-4-yl)pyrrolidin-3-amine
CAS Number:
1310558-47-4
Molecular Formula:
C8H10ClFN4
Molecular Weight:
216.6432
MDL Number:
MFCD23703734
IUPAC Name:
1-(2-chloro-5-fluoropyrimidin-4-yl)pyrrolidin-3-amine
InChI:
InChI=1S/C8H10ClFN4/c9-8-12-3-6(10)7(13-8)14-2-1-5(11)4-14/h3,5H,1-2,4,11H2
InChI Key:
OMPPWUACLONIIR-UHFFFAOYSA-N
SMILES:
NC1CCN(C1)c1nc(Cl)ncc1F
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.058g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.644g/mol
Monoisotopic Mass:
216.058g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties