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2-Methylbutan-2-yl-[(pyridin-1-ium-3-ylamino)-(pyrimidin-2-ylamino)methylidene]azanium dichloride

CAS
67026-84-0
Catalog Number
ACM67026840
Category
Other Products
Molecular Weight
357.281 g/mol
Molecular Formula
C15H22Cl2N6

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Specification

Synonyms
CID48883, LS-73856, 1-tert-Pentyl-3-(3-pyridyl)-2-pyrimidylguanidine dihydrochloride, GUANIDINE, 1-tert-PENTYL-3-(3-PYRIDYL)-2-PYRIMIDYL-, DIHYDROCHLORIDE, 67026-84-0
IUPAC Name
2-methylbutan-2-yl-[(pyridin-1-ium-3-ylamino)-(pyrimidin-2-ylamino)methylidene]azanium dichloride
Canonical SMILES
CCC(C)(C)N=C(NC1=CN=CC=C1)NC2=NC=CC=N2.Cl
InChI Key
ALGSCLXQQRMRFJ-UHFFFAOYSA-N
Boiling Point
443.6ºC at 760 mmHg
Melting Point
233-234ºC
Flash Point
222.1ºC
Density
1.14g/cm³
Exact Mass
320.15200
H-Bond Acceptor
6
H-Bond Donor
4
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