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S-(2-(N-((4-Amino-2-Methylpyrimidin-5-Yl)Methyl)Formamido)-5-(Phosphonooxy)Pent-2-En-3-Yl) 3-Phenylprop-2-Enethioate
S-(2-(N-((4-Amino-2-Methylpyrimidin-5-Yl)Methyl)Formamido)-5-(Phosphonooxy)Pent-2-En-3-Yl) 3-Phenylprop-2-Enethioate / CAS : 751-21-3
| Appearance | White to slightly beige Powder | UN | 2926 |
| HS | 34021100 | DG Class | 4.1 |
| Synonyms | 3-Phenyl-Thioacrylic Acid S-{2-[(4-Amino-2-Methyl-Pyrimidin-5-Ylmethyl)-Formyl-Amino]-1-(2-Phosphonooxy-Ethyl)-Propenyl} Ester; Sds Sodium Salt; Dodecylsulfuric Acid Sodium Salt; Lauryl Sodium Sulfate; Lauryl Sulfate Na-Salt; Lauryl Sulfate, Sodium; Laurylsulfuric Acid Sodium Salt | ||
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Properties
Summary
Formula
C21H25N4O6PS
Molecular Mass
492.48500
Exact Mass
492.12300
PSA
191.05000
Logp
4.24680
IUPAC
S-[(E)-2-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-5-phosphonooxypent-2-en-3-yl] (E)-3-phenylprop-2-enethioate
SMILES
CC1=NC=C(C(=N1)N)CN(C=O)/C(=C(\CCOP(=O)(O)O)/SC(=O)/C=C/C2=CC=CC=C2)/C
Attribute classification
Matter Classification
organic
Category
Cosmetics > Daily Chemical Additives
Surfactants, Catalysts > Surface Active Agent
Surfactants, Catalysts > Surface Active Agent
Chemical and Physical Properties
Melting Point
206-207ºC
Density
1.03 g/mL
Boiling Point
776.8±70.0 °C
Appearance
White to slightly beige Powder
Acidity and Basicity
neutral
Export information
HS Code
34021100
Export Rebate
13%
UN No.
2926
DG-Class
4.1
Risk Code
R36/37/38
Safety Label
Xi
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