Products Categories
CAS No.: | 1022-79-3 |
---|---|
Name: | 5-Bromo-2'-deoxycytidine |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C9H12BrN3O4 |
Molecular Weight: | 306.116 |
Synonyms: | 5-Bromodeoxycytidine;NSC 61765;4-Amino-5-bromo-1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one; |
EINECS: | 213-824-2 |
Density: | 2.13 g/cm3 |
Boiling Point: | 510.81 °C at 760 mmHg |
Flash Point: | 262.728 °C |
Hazard Symbols: | Xn |
Risk Codes: | 40 |
Safety: | 22-36 |
PSA: | 110.60000 |
LogP: | -0.19010 |
What can I do for you?
Get Best Price
The CAS register number of 5-Bromo-2'-deoxycytidine is 1022-79-3. It also can be called as Cytidine,5-bromo-2'-deoxy- and the IUPAC name about this chemical is 4-amino-5-bromo-1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one. The molecular formula about this chemical is C9H12BrN3O4 and the molecular weight is 306.11. It belongs to the Nucleotides and Nucleic Acids. This chemical can be incorporated into DNA in the presence of DNA polymerase, replacing dCTP.
Physical properties about 5-Bromo-2'-deoxycytidine are: (1)ACD/LogP: -0.98; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 6.97; (5)ACD/KOC (pH 7.4): 6.98; (6)#H bond acceptors: 7; (7)#H bond donors: 4; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 63.6Å2; (10)Index of Refraction: 1.763; (11)Molar Refractivity: 59.34 cm3; (12)Molar Volume: 143.7 cm3; (13)Polarizability: 23.52x10-24cm3; (14)Surface Tension: 82.4 dyne/cm; (15)Flash Point: 262.7 °C; (16)Enthalpy of Vaporization: 89.98 kJ/mol; (17)Boiling Point: 510.8 °C at 760 mmHg; (18)Vapour Pressure: 1.43E-12 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Br\C\1=C\N(C(=O)/N=C/1/N)[C@H]2C[C@H](O)[C@@H](CO)O2
(2)InChI: InChI=1/C9H12BrN3O4/c10-4-2-13(9(16)12-8(4)11)7-1-5(15)6(3-14)17-7/h2,5-7,14-15H,1,3H2,(H2,11,12,16)/t5-,6+,7+/m0/s1
(3)InChIKey: KISUPFXQEHWGAR-RRKCRQDMBR
(4)Std. InChI: InChI=1S/C9H12BrN3O4/c10-4-2-13(9(16)12-8(4)11)7-1-5(15)6(3-14)17-7/h2,5-7,14-15H,1,3H2,(H2,11,12,16)/t5-,6+,7+/m0/s1
(5)Std. InChIKey: KISUPFXQEHWGAR-RRKCRQDMSA-N