Name: 2-Aminopyrimidine-5-carbonitrile
SKU: 1753-48-6

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Basic Information

Molecular Structure:
CAS No.:	1753-48-6
Name:	2-Aminopyrimidine-5-carbonitrile
Article Data:	7

Formula:	C₅H₄N₄
Molecular Weight:	120.11
Synonyms:	2-Amino-5-cyanopyrimidine;2-Amino-5-pyrimidinecarbonitrile;5-Cyano-2-pyrimidinamine;
Density:	1.346 g/cm³
Melting Point:	300-310 °C (decomp)
Boiling Point:	387.862 °C at 760 mmHg
Flash Point:	188.372 °C
Risk Codes:	41
Safety:	26-39
PSA:	75.59000
LogP:	0.51168

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Specification

The CAS register number of 2-Aminopyrimidine-5-carbonitrile is 1753-48-6. It also can be called as 5-Pyrimidinecarbonitrile,2-amino- and the IUPAC name about this chemical is 2-aminopyrimidine-5-carbonitrile. The molecular formula about this chemical is C₅H₄N₄and molecular weight is 120.11. It belongs to the following product categories which include Pyrimidine; API intermediates and so on.

Physical properties about 2-Aminopyrimidine-5-carbonitrile are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 9.525; (4)ACD/KOC (pH 7.4): 9.525; (5)#H bond acceptors: 4; (6)#H bond donors: 2; (7)Polar Surface Area: 75.59Å²; (8)Index of Refraction: 1.6; (9)Molar Refractivity: 30.535 cm³; (10)Molar Volume: 89.24 cm³; (11)Polarizability: 12.105x10^-24cm³; (12)Surface Tension: 86.399 dyne/cm; (13)Flash Point: 188.372 °C; (14)Enthalpy of Vaporization: 63.699 kJ/mol; (15)Boiling Point: 387.862 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c(cnc(n1)N)C#N
(2)InChI: InChI=1/C5H4N4/c6-1-4-2-8-5(7)9-3-4/h2-3H,(H2,7,8,9)
(3)InChIKey: SEUSFEKWVIFWTN-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C5H4N4/c6-1-4-2-8-5(7)9-3-4/h2-3H,(H2,7,8,9)
(5)Std. InChIKey: SEUSFEKWVIFWTN-UHFFFAOYSA-N