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1261234-26-7 | Pyrimidine, 4-chloro-5-methyl-2-(2-methyl-1-piperazinyl)-, hydrochloride (1:1)
CAS No: 1261234-26-7 Catalog No: AG000ROB MDL No:MFCD18380385
Product Description
Catalog Number:
AG000ROB
Chemical Name:
Pyrimidine, 4-chloro-5-methyl-2-(2-methyl-1-piperazinyl)-, hydrochloride (1:1)
CAS Number:
1261234-26-7
Molecular Formula:
C10H16Cl2N4
Molecular Weight:
263.1668
MDL Number:
MFCD18380385
IUPAC Name:
4-chloro-5-methyl-2-(2-methylpiperazin-1-yl)pyrimidine;hydrochloride
InChI:
InChI=1S/C10H15ClN4.ClH/c1-7-5-13-10(14-9(7)11)15-4-3-12-6-8(15)2;/h5,8,12H,3-4,6H2,1-2H3;1H
InChI Key:
YMIXNJMOICRVQW-UHFFFAOYSA-N
SMILES:
CC1CNCCN1c1ncc(c(n1)Cl)C.Cl
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.075g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
263.166g/mol
Monoisotopic Mass:
262.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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