Products Categories
CAS No.: | 33430-62-5 |
---|---|
Name: | Thymidine-5'-monophosphate disodium salt |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C10H13N2Na2O8P |
Molecular Weight: | 366.175 |
Synonyms: | 5'-Thymidylicacid, disodium salt (8CI,9CI);Disodium 5'-dTMP;Disodium TMP;Thymidine5'-monophosphate disodium salt; |
EINECS: | 251-518-0 |
Melting Point: | >300 °C |
Solubility: | Soluble in water. |
Appearance: | White amorphous powder |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-37/39 |
PSA: | 166.55000 |
LogP: | -0.52090 |
What can I do for you?
Get Best Price
The 5'-Thymidylic acid disodium salt with the CAS number 33430-62-5 is also called Disodium 5'-dTMP. The IUPAC name is [(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dihydrogen phosphate. Its molecular formula is C10H13N2Na2O8P. The EINECS registry number is 251-518-0. This chemical belongs to the following product categories: (1)Biochemistry; (2)Nucleosides, Nucleotides & Related Reagents; (3)Nucleotides and their analogs; (4)Nucleic acids.
The properties of the 5'-Thymidylic acid disodium salt are: (1)ACD/LogP: -1.60; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -4.93; (4)ACD/LogD (pH 7.4): -5.87; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 10; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 135.65 Å2.
While using this chemical, you should be very cautious. This chemical is not only irritating to skin, but also irritating to eyes and respiratory system. Therefore, you should take the following instructions. Firstly, you should wear suitable gloves and eye/face protection. Then in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].[Na+].[O-]P([O-])(=O)OC[C@H]2O[C@@H](N\1C(=O)NC(=O)/C(=C/1)C)C[C@@H]2O
(2)InChI: InChI=1/C10H15N2O8P.2Na/c1-5-3-12(10(15)11-9(5)14)8-2-6(13)7(20-8)4-19-21(16,17)18;;/h3,6-8,13H,2,4H2,1H3,(H,11,14,15)(H2,16,17,18);;/q;2*+1/p-2/t6-,7+,8+;;/m0../s1
(3)InChIKey: AGSQMPPRYZYDFV-YDRITVCPBO