Home Halogens 2-chloro-N-(oxan-3-yl)pyrimidin-4-amine

2-chloro-N-(oxan-3-yl)pyrimidin-4-amine

CAS No.:
1342391-78-9
Catalog Number:
AG01AGGP
Molecular Formula:
C9H12ClN3O
Molecular Weight:
213.6641
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Product Description
Catalog Number:
AG01AGGP
Chemical Name:
2-chloro-N-(oxan-3-yl)pyrimidin-4-amine
CAS Number:
1342391-78-9
Molecular Formula:
C9H12ClN3O
Molecular Weight:
213.6641
MDL Number:
MFCD18339407
IUPAC Name:
2-chloro-N-(oxan-3-yl)pyrimidin-4-amine
InChI:
InChI=1S/C9H12ClN3O/c10-9-11-4-3-8(13-9)12-7-2-1-5-14-6-7/h3-4,7H,1-2,5-6H2,(H,11,12,13)
InChI Key:
SMEWBGPILUISCA-UHFFFAOYSA-N
SMILES:
Clc1nccc(n1)NC1CCCOC1
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.665g/mol
Monoisotopic Mass:
213.067g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties