2,5-Diaminepyrimidine

CAT: 0127-OR74097-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR74097-01Size:250 mg

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CAS Number

22715-27-1

MDL Number

MFCD00129726

Purity

97%

Smiles

NC1=NC=C(N)C=N1

Chemical Information

Pyrimidine-2,5-diamine

CAS Number	22715-27-1
PubChem CID	229075
IUPAC Name	pyrimidine-2,5-diamine
Molecular Formula	C4H6N4
Molecular Weight	110.12
XLogP	-0.8
Topological Polar Surface Area	77.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Heavy Atom Count	8
Formal Charge	0
Complexity	66

SMILES

C1=C(C=NC(=N1)N)N

InChI

InChI=1S/C4H6N4/c5-3-1-7-4(6)8-2-3/h1-2H,5H2,(H2,6,7,8)

InChIKey

DNACGYGXUFTEHO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 22715-27-1

CID: 229075

Formula: C4H6N4

MW: 110.12

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	110.12
XLogP3	-0.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	110.059246208
Monoisotopic Mass	110.059246208
Topological Polar Surface Area	77.8 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	66.4
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1069815-01	2,4-Diaminopyrimidine-5-carboxamide
OR480761-01	2,4-Diaminopyrimidine-5-carbonitrile
OR79719-01	2,4-Diaminopyrimidine-5-carbaldehyde
OR90479-01	5,6-Diaminopyrimidine-2,4-diol
OR93770	Ethyl 2,4-diaminopyrimidine-5-carboxylate
OR1050697-01	2,4-diaminopyrimidin-5-ol dihydrochloride
OR81167-01	2,5-Diaminopyrimidin-4 (3H) -one
OR81973-01	5-[ (4-Benzyloxy) benzyl]-2,4-diaminopyrimidine
OR1070107-01	(2,4-Diaminopyrimidin-5-yl) (3,4,5-trimethoxyphenyl) methanol
OR1079314	5,5'''-Dihexyl-2,2':5',2'':5'',2'''-quaterthiophene

Catalog	Name
sc-227020	5,5''-Dibromo-2,2':5',2''-terthiophene
sc-477057	2,2':5',2''-Terthiophene-5,5''-dicarboxaldehyde
sc-474109	2,2′:5′,2′′:5′′,2′′′-Quaterthiophene
QAA72102	2,2',5,5'-Tetrachlorobenzidine
419550-01	2,2',5,5'-Tetrachlorobiphenyl
FT172401-01	2,2,5,5-Tetramethyloxolane
sc-265954	2,2',5,5'-Tetramethylbiphenyl
JH464578	2,2,5,5-tetramethyl-1,2,5-oxadisilolane
EAA37887-01	1, 2, 5-Oxadithiolane 2, 2, 5, 5-tetraoxide
437368-01	5''-Bromo-[2,2':5',2''-terthiophene]-5-carbaldehyde