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Structure

2,4-Diamino-6-[2-(2-methyl-1-imidazolyl)ethyl]-1,3,5-triazine

CAS
38668-46-1
Catalog Number
ACM-MO-38668461
Category
Other Products; Amide & Amine Monomers
Molecular Weight
219.25 g/mol
Molecular Formula
C9H13N7

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Specification

IUPAC Name
6-[2-(2-methylimidazol-1-yl)ethyl]-1,3,5-triazine-2,4-diamine
Canonical SMILES
CC1=NC=CN1CCC2=NC(=NC(=N2)N)N
InChI
InChI=1S/C9H13N7/c1-6-12-3-5-16(6)4-2-7-13-8(10)15-9(11)14-7/h3,5H,2,4H2,1H3,(H4,10,11,13,14,15)
InChI Key
DRQWQDPSMJHCCM-UHFFFAOYSA-N
Melting Point
253 °C
Appearance
White to Almost White Powder to Crystal
Complexity
214
Covalently-Bonded Unit Count
1
Degree of solubility in water
7 g/l 20 °C
EC Number
254-074-6
Exact Mass
219.123243g/mol
Formal Charge
0
H-Bond Acceptor
6
H-Bond Donor
2
Heavy Atom Count
16
Monoisotopic Mass
219.123243g/mol
Physical State
Solid
Rotatable Bond Count
3
XLogP3
-0.3
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