Basic information
- CAS
93939-70-9- Standard SMILES
Nc1ncnc2c1ncn2[C@H]1CC[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O1.[Li+].[Li+].[Li+]- InChIKey
ZTVIJXZPFNMGOR-PXJNTPRPSA-N- Molecular formula
- C10H16Li3N5O11P3+3
- Average molar mass
- 496.1 g/mol
- Monoisotopic mass
- 496.0539276
Names & identifiers
- Preferred name
- adenosine 5'-(tetrahydrogen triphosphate), 2',3'-dideoxy-, trilithium salt
- IUPAC
- trilithium;[[(2S,5R)-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
- English name
- 2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATE LITHIUM SALT
- Molecular formula
- C10H13Li3N5O11P3
- Molecular weight
- 492.98
Names & synonyms
93939-70-9Adenosine 5'-(tetrahydrogen triphosphate), 2',3'-dideoxy-, trilithium saltEINECS 300-359-6RefChem:552978300-359-6trilithium;[[(2S,5R)-5-(6-aminopurin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphateZTVIJXZPFNMGOR-PXJNTPRPSA-NC10H16Li3N5O11P3+3ND10279ND320772',3'-Dideoxyadenosine-5'-triphosphate lithium2',3'-Dideoxyadenosine-5'-triphosphate lithium salt - 100mM aqueous solution
Show more names
ddATP-Li32',3'-DIDEOXYADENOSINE 5'-TRIPHOSPHATE TRI-LI-SALT*2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATE LITHIUM SALTADENOSINE5'-(TETRAHYDROGEN TRIPHOSPHATE), 2',3'-D...2',3'-DIDEOXYADENOSINE 5'-TRIPHOSPHATE*L ITHIUM 10 M2',3'-Dideoxyadenosine 5'-Triphosphate lithurn Salt2',3'-dideoxyadenosine 5'-triphosphate trilithium salt2'',3''-Dideoxyadenosine-5''-triphosphoric acid trilithium salt2′,3′-Dideoxyadenosine-5′-triphosphate Lithium Salt, CAS 93939-70-9
Properties
Computed structural properties
- Topological polar surface area
- 239 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 3
- Complexity
- 738
Physicochemical properties
- storage temp.
- 20 °C · −20°C
- Symbol(GHS)
- 8 · GHS08,GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H361
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P201-P202-P281-P308+P313-P405-P501
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-63
- Safety Statements
- 36 · 36/37
- RIDADR
- 2811 · UN 2811 6.1/PG 3
- WGK Germany
- 3 · 3
- F
- 10 · 10-21
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P203, P264, P270, P280, P301+P317, P318, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- F
- 10-21
- wgk
- 3
- ridadr
- UN 2811 6.1/PG 3
- risk_code
- 22-63
- Signal word
- Warning
- Symbol(GHS)
- GHS08,GHS07
- hazard_code
- Xn
- safety_code
- 36/37
- Hazard statements
- H302-H361
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P201-P202-P281-P308+P313-P405-P501
Chemistry & industry
Suppliers4 total
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
上海梅凯科技有限公司021-68689288 15300790979 · [email protected]
BOC Sciences16314854226 · [email protected]
上海相辉医药科技有限公司[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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