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81250-33-1

Basic Information
CAS No.: 81250-33-1
Name: 6-Amino-1,3-dipropyl-5-nitroso uracil
Article Data: 14
Cas Database
Molecular Structure:
Molecular Structure of 81250-33-1 (6-Amino-1,3-dipropyl-5-nitroso uracil)
Formula: C10H16N4O3
Molecular Weight: 240.259
Synonyms: 6-Amino-5-nitroso-1,3-di-n-propyl-1H-pyrimidine-2,4-dione;6-amino-5-nitroso-1,3-dipropylpyrimidine-2,4(1H,3H)-dione;
EINECS: N/A
Density: 1.34 g/cm3
Melting Point: 205-210 °C
Boiling Point: 309.4 °C at 760 mmHg
Flash Point: 140.9 °C
Solubility: N/A
Appearance: Purple Solid
Hazard Symbols: N/A
Risk Codes: N/A
Safety:
Transport Information: N/A
PSA: 99.45000
LogP: 1.39130
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    Product Name: 6-Amino-1,3-dipropyl-5-nitrosouracil CAS: 81250-33-1 MF: C10H16N4O3 MW: 240.26 EINECS: Mol File: 81250-33-1.mol 6-Amino-1,3-dipropyl-5-nitrosouracil Structure 6-Amino-1,3-dipropyl-5-nitrosouracil Chemical Properties

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Specification

The CAS register number of 6-Amino-1,3-dipropyl-5-nitroso uracil is 81250-33-1. It also can be called as 6-Amino-5-nitroso-1,3-di-n-propyl-1H-pyrimidine-2,4-dione and the systematic name about this chemical is 6-amino-5-nitroso-1,3-dipropylpyrimidine-2,4(1H,3H)-dione. The molecular formula about this chemical is C10H16N4O3 and the molecular weight is 240.259. It belongs to the following product categories which include Nucleotides and Nucleosides; Bases & Related Reagents; Intermediates; Nucleotides and so on. This chemical is an intermediate used for the synthesis of xanthine derivatives.

Physical properties about 6-Amino-1,3-dipropyl-5-nitroso uracil are: (1)ACD/LogP: 2.18; (2)ACD/LogD (pH 5.5): 2.18; (3)ACD/LogD (pH 7.4): 2.18; (4)ACD/BCF (pH 5.5): 26.89; (5)ACD/BCF (pH 7.4): 26.89; (6)ACD/KOC (pH 5.5): 367.17; (7)ACD/KOC (pH 7.4): 367.17; (8)#H bond acceptors: 7; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 6; (11)Polar Surface Area: 73.29Å2; (12)Index of Refraction: 1.601; (13)Molar Refractivity: 61.14 cm3; (14)Molar Volume: 178.3 cm3; (15)Polarizability: 24.24x10-24cm3; (16)Surface Tension: 53.7 dyne/cm; (17)Flash Point: 140.9 °C; (18)Enthalpy of Vaporization: 55.01 kJ/mol; (19)Boiling Point: 309.4 °C at 760 mmHg; (20)Vapour Pressure: 0.000642 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1C(\N=O)=C(/N(C(=O)N1CCC)CCC)N
(2)InChI: InChI=1/C10H16N4O3/c1-3-5-13-8(11)7(12-17)9(15)14(6-4-2)10(13)16/h3-6,11H2,1-2H3
(3)InChIKey: HLHWJHPBAYITQE-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C10H16N4O3/c1-3-5-13-8(11)7(12-17)9(15)14(6-4-2)10(13)16/h3-6,11H2,1-2H3
(5)Std. InChIKey: HLHWJHPBAYITQE-UHFFFAOYSA-N