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1378891-09-8 | 5-IODO-2-(PIPERIDIN-1-YL)PYRIMIDINE
CAS No: 1378891-09-8 Catalog No: AG01BT5Z MDL No:MFCD11870537
Product Description
Catalog Number:
AG01BT5Z
Chemical Name:
5-IODO-2-(PIPERIDIN-1-YL)PYRIMIDINE
CAS Number:
1378891-09-8
Molecular Formula:
C9H12IN3
Molecular Weight:
289.1161
MDL Number:
MFCD11870537
IUPAC Name:
5-iodo-2-piperidin-1-ylpyrimidine
InChI:
InChI=1S/C9H12IN3/c10-8-6-11-9(12-7-8)13-4-2-1-3-5-13/h6-7H,1-5H2
InChI Key:
MKANLGBTRVQHPN-UHFFFAOYSA-N
SMILES:
Ic1cnc(nc1)N1CCCCC1
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.008g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.12g/mol
Monoisotopic Mass:
289.008g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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