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157327-52-1

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Basic Information
CAS No.: 157327-52-1
Name: 6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-amine
Molecular Structure:
Molecular Structure of 157327-52-1 (6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-amine)
Formula: C6H8N4.2(HCl)
Molecular Weight: 209.08
Synonyms: 6,7-Dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-amine dihydrochloride;6,7-Dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-ylamine;6,7-Dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-amine hydrochloride;2-Amino-5,7-dihydropyrrolo[3,4-d]pyrimidine dihydrochloride;
Boiling Point: 382.5 °C at 760 mmHg
Flash Point: 185.1 °C
PSA: 64.56000
LogP: 0.72290
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Specification

The CAS register number of 2-Amino-5,7-dihydropyrrolo[3,4-d]pyrimidine dihydrochloride is 157327-52-1. The systematic name about this chemical is 2-ammonio-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-6-ium dichloride. The molecular formula about this chemical is C6H8N4.2(HCl) and the molecular weight is 209.08.

Physical properties about 2-Amino-5,7-dihydropyrrolo[3,4-d]pyrimidine dihydrochloride are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 3; (4)ACD/KOC (pH 7.4): 4; (5)#H bond acceptors: 4; (6)#H bond donors: 3; (7)Polar Surface Area: 25.78Å2; (8)Flash Point: 185.1 °C; (9)Enthalpy of Vaporization: 63.09 kJ/mol; (10)Boiling Point: 382.5 °C at 760 mmHg; (11)Vapour Pressure: 4.7E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].[Cl-].n1c2c(cnc1[NH3+])C[NH2+]C2
(2)InChI: InChI=1/C6H8N4.2ClH/c7-6-9-2-4-1-8-3-5(4)10-6;;/h2,8H,1,3H2,(H2,7,9,10);2*1H
(3)InChIKey: IDVFIDIYCKHAEX-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C6H8N4.2ClH/c7-6-9-2-4-1-8-3-5(4)10-6;;/h2,8H,1,3H2,(H2,7,9,10);2*1H
(5)Std. InChIKey: IDVFIDIYCKHAEX-UHFFFAOYSA-N