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Home> Hot Product Listed 5   > 5'-Adenylic acid, 3'-amino-3'-deoxy-
633-65-8 structure

5'-Adenylic acid, 3'-amino-3'-deoxy-

CAS No.:633-65-8
Molecular Weight:336.36122
Molecular Formula:C15H24O (isomer)
Names and Identifiers
Synonyms

[(2s,3s,4r,5r)-3-amino-5-(6-aminopurin-9-yl)-4-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate 3'-amino-3'-deoxyadenosine 5'-(dihydrogen phosphate) 3'-amino-3'-deoxy-amp C07026 CTK1D2678 DTXSID70672990 SCHEMBL6763100 surecn6763100

Inchi
InChI=1/C20H18NO4.ClH/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2;/h3-4,7-10H,5-6,11H2,1-2H3;1H/q+1;/p-1
Canonical Smiles
COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC
Properties
Melting Point
200℃
Flash Point
282.8°C
Safety and Handling
Risk Statements
R20/21/22
Safety Statements
S24/25
HazardClass
6.1(b)
PackingGroup
III
Transport
1544
Reach Info
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Not classified.

2.2 GHS label elements, including precautionary statements

Pictogram(s) No symbol.
Signal word

No signal word.

Hazard statement(s)

none

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:336.36122g/mol
  • Molecular Formula:C15H24O
  • Exact Mass:336.123583
  • Monoisotopic Mass:336.123583
  • Complexity:488
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:40.8
  • Heavy Atom Count:25
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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Recommended Suppliers
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  • Tel:86-571-85829152
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