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CAT: 1106-BLG-T012-25Size: 5x 5 μmoLDry Ice: NoHazardous: No
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CAT#:1106-BLG-T012-25Size:5x 5 μmoL
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2863-04-9
Product Name Alternative
Thymidine-3′,5′-O-bisphosphate/2′-Deoxythymidine-3′,5′-O-bisphosphate . sodium salt
Certification
RUO
Type
Modified nucleotides
Purity
> 95% HPLC
Molecular Formula
C 10 H 16 N 2 O 11 P 2 (free acid)
Molecular Weight
402.2
Shipping Conditions
Ambient Temperature
Storage Conditions
-20°C
Notes
For the Original Manufacturer’s data sheet please click here .

Chemical Information

Thymidine 3',5'-diphosphate
CAS Number2863-04-9
PubChem CID121976
IUPAC Name[(2R,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-2-(phosphonooxymethyl)oxolan-3-yl] dihydrogen phosphate
Molecular FormulaC10H16N2O11P2
Molecular Weight402.19
XLogP-3.5
Topological Polar Surface Area192
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count11
Rotatable Bond Count6
Heavy Atom Count25
Formal Charge0
Complexity682
SMILES
CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(O)O)OP(=O)(O)O
InChI
InChI=1S/C10H16N2O11P2/c1-5-3-12(10(14)11-9(5)13)8-2-6(23-25(18,19)20)7(22-8)4-21-24(15,16)17/h3,6-8H,2,4H2,1H3,(H,11,13,14)(H2,15,16,17)(H2,18,19,20)/t6-,7+,8+/m0/s1
InChIKey
CSNCBOPUCJOHLS-XLPZGREQSA-N
Chemical Structure
2D Structure
2D structure of Thymidine 3',5'-diphosphate
CAS: 2863-04-9
CID: 121976
Formula: C10H16N2O11P2
MW: 402.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight402.19
XLogP3-3.5
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count11
Rotatable Bond Count6
Exact Mass402.02293333
Monoisotopic Mass402.02293333
Topological Polar Surface Area192 Ų
Heavy Atom Count25
Formal Charge0
Complexity682
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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