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98141-15-2

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Basic Information
CAS No.: 98141-15-2
Name: Purine, 6-(aminomethyl)- (6CI)
Molecular Structure:
Molecular Structure of 98141-15-2 (Purine, 6-(aminomethyl)- (6CI))
Formula: C6H7N5
Molecular Weight: 149.155
Synonyms: Purine,6-(aminomethyl)- (6CI);
Density: 1.469 g/cm3
Boiling Point: 485.223 °C at 760 mmHg
Flash Point: 279.024 °C
PSA: 80.48000
LogP: 0.51190
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  • Purine, 6-(aminomethyl)- (6CI)

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    Purine, 6-(aminomethyl)- (6CI)

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Specification

The 9H-Purine-6-methanamine is an organic compound with the formula C6H7N5. The IUPAC name of this chemical is 7H-purin-6-ylmethanamine. With the CAS registry number 98141-15-2, it is also named as 1-(7H-purin-6-yl)methanamine. The product's category is Pyrimidine.

Physical properties about 9H-Purine-6-methanamine are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 1; (4)ACD/KOC (pH 7.4): 3.469; (5)#H bond acceptors: 5; (6)#H bond donors: 3; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 80.48 Å2; (9)Index of Refraction: 1.747; (10)Molar Refractivity: 41.254 cm3; (11)Molar Volume: 101.531 cm3; (12)Polarizability: 16.354×10-24cm3; (13)Surface Tension: 97.447 dyne/cm; (14)Density: 1.469 g/cm3; (15)Flash Point: 279.024 °C; (16)Enthalpy of Vaporization: 75.068 kJ/mol; (17)Boiling Point: 485.223 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: c1[nH]c2c(ncnc2n1)CN
(2)InChI: InChI=1/C6H7N5/c7-1-4-5-6(10-2-8-4)11-3-9-5/h2-3H,1,7H2,(H,8,9,10,11)
(3)InChIKey: FELHYNZKVDMRSU-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C6H7N5/c7-1-4-5-6(10-2-8-4)11-3-9-5/h2-3H,1,7H2,(H,8,9,10,11)
(5)Std. InChIKey: FELHYNZKVDMRSU-UHFFFAOYSA-N