-
Name
2-CHLORO-N-(6-METHYL-2,4-DIOXO-1,2,3,4-TETRAHYDRO-PYRIMIDIN-5-YL)-ACETAMIDE
- EINECS
- CAS No. 27870-38-8
- Density 1.49 g/cm3
- Solubility
- Melting Point
- Formula C7H8ClN3O3
- Boiling Point
- Molecular Weight 217.612
- Flash Point
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
-
Hazard Symbols
Xi
- Synonyms Uracil,5-(2-chloroacetamido)-6-methyl- (6CI);5-Chloroacetamido-6-methyluracil;2-Chloro-n-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydro-pyrimidin-5-yl)-acetamide;
- PSA
- LogP
Acetamide,2-chloro-N-(1,2,3,4-tetrahydro-6-methyl-2,4-dioxo-5-pyrimidinyl)- Specification
The CAS register number of Acetamide,2-chloro-N-(1,2,3,4-tetrahydro-6-methyl-2,4-dioxo-5-pyrimidinyl)- is 27870-38-8. It also can be called as 5-Chloroacetamido-6-methyluracil and the systematic name about this chemical is 2-chloro-N-(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)acetamide. The molecular formula about this chemical is C7H8ClN3O3 and the molecular weight is 217.61. This chemical is irritant and it may cause inflammation to the skin or other mucous membranes.
Physical properties about Acetamide,2-chloro-N-(1,2,3,4-tetrahydro-6-methyl-2,4-dioxo-5-pyrimidinyl)- are: (1)ACD/LogP: -0.31; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 16.2; (5)ACD/KOC (pH 7.4): 15.76; (6)#H bond acceptors: 6; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 60.93 Å2; (10)Index of Refraction: 1.575; (11)Molar Refractivity: 47.99 cm3; (12)Molar Volume: 145.2 cm3; (13)Polarizability: 19.02x10-24cm3; (14)Surface Tension: 57.6 dyne/cm; (15)Density: 1.49 g/cm3.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C1N/C(=C(/NC(=O)CCl)C(=O)N1)C
(2)InChI: InChI=1/C7H8ClN3O3/c1-3-5(10-4(12)2-8)6(13)11-7(14)9-3/h2H2,1H3,(H,10,12)(H2,9,11,13,14)
(3)InChIKey: BPJLEHPOYRPITQ-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C7H8ClN3O3/c1-3-5(10-4(12)2-8)6(13)11-7(14)9-3/h2H2,1H3,(H,10,12)(H2,9,11,13,14)
(5)Std. InChIKey: BPJLEHPOYRPITQ-UHFFFAOYSA-N
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