Cytidine,2'-deoxy-N,N,5-trimethyl- (8CI,9CI) supplier

Name
Cytidine, 2'-deoxy-N,N,5-trimethyl-
EINECS
CAS No. 25406-45-5
Article Data3
CAS DataBase
Density 1.41 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₉N₃O₄
Boiling Point 457.3 °C at 760 mmHg
Molecular Weight 269.301
Flash Point 230.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-(dimethylamino)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one;
PSA 87.82000
LogP -0.74160

Cytidine,2'-deoxy-N,N,5-trimethyl- (8CI,9CI) Specification

The Cytidine,2'-deoxy-N,N,5-trimethyl- (8CI,9CI), also known as 4-Dimethylaminothymidine, is an organic compound with the formula C₁₂H₁₉N₃O₄. With the CAS registry number 25406-45-5, its IUPAC name is 4-(dimethylamino)-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one.

Physical properties of Cytidine,2'-deoxy-N,N,5-trimethyl- (8CI,9CI): (1)ACD/LogP: -0.99; (2)ACD/LogD (pH 5.5): -1.03; (3)ACD/LogD (pH 7.4): -0.99; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 6.23; (7)ACD/KOC (pH 7.4): 6.91; (8)#H bond acceptors: 7; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Index of Refraction: 1.62; (12)Molar Refractivity: 67.1 cm³; (13)Molar Volume: 190.8 cm³; (14)Surface Tension: 50.8 dyne/cm; (15)Density: 1.41 g/cm³; (16)Flash Point: 230.4 °C; (17)Enthalpy of Vaporization: 82.75 kJ/mol; (18)Boiling Point: 457.3 °C at 760 mmHg; (19)Vapour Pressure: 2.75E-10 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CN(C(=O)N=C1N(C)C)C2CC(C(O2)CO)O
(2)Isomeric SMILES: CC1=CN(C(=O)N=C1N(C)C)[C@H]2C[C@@H]([C@H](O2)CO)O
(3)InChI: InChI=1S/C12H19N3O4/c1-7-5-15(12(18)13-11(7)14(2)3)10-4-8(17)9(6-16)19-10/h5,8-10,16-17H,4,6H2,1-3H3/t8-,9+,10+/m0/s1
(4)InChIKey: XFVZGRVQZIWASI-IVZWLZJFSA-N

Product Name

Cytidine, 2'-deoxy-N,N,5-trimethyl-

Cytidine,2'-deoxy-N,N,5-trimethyl- (8CI,9CI) Specification

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