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1864014-87-8 | 5-(1,2,3,6-TETRAHYDROPYRIDIN-4-YL)PYRIMIDINE DIHYDROCHLORIDE
CAS No: 1864014-87-8 Catalog No: AG01AS7Y MDL No:MFCD28166110
Product Description
Catalog Number:
AG01AS7Y
Chemical Name:
5-(1,2,3,6-TETRAHYDROPYRIDIN-4-YL)PYRIMIDINE DIHYDROCHLORIDE
CAS Number:
1864014-87-8
Molecular Formula:
C9H13Cl2N3
Molecular Weight:
234.1256
MDL Number:
MFCD28166110
IUPAC Name:
5-(1,2,3,6-tetrahydropyridin-4-yl)pyrimidine;dihydrochloride
InChI:
InChI=1S/C9H11N3.2ClH/c1-3-10-4-2-8(1)9-5-11-7-12-6-9;;/h1,5-7,10H,2-4H2;2*1H
InChI Key:
OUHHBLZNJQYICR-UHFFFAOYSA-N
SMILES:
N1CCC(=CC1)c1cncnc1.Cl.Cl
Properties
Complexity:
171
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.049g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
234.124g/mol
Monoisotopic Mass:
233.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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