Cas no 31077-38-0 (5'-Adenylic acid,dilithium salt (8CI,9CI))

5'-Adenylic acid,dilithium salt (8CI,9CI) structure
31077-38-0 structure
Product Name:5'-Adenylic acid,dilithium salt (8CI,9CI)
CAS No:31077-38-0
MF:C10H14N5O7P
MW:347.221222400665
CID:308894
PubChem ID:224
Update Time:2025-04-19

5'-Adenylic acid,dilithium salt (8CI,9CI) Chemical and Physical Properties

Names and Identifiers

    • 5'-Adenylic acid,dilithium salt (8CI,9CI)
    • [5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
    • 9-(5-O-phosphonopentofuranosyl)-9H-purin-6-amine
    • 9H-Purine, 5'-phosphate
    • A 5MP
    • AC1Q6RZR
    • ACMC-209mq0
    • Ara-AMP
    • NSC127223
    • NSC20264
    • SureCN144997
    • Vidarabine5'-monophosphate
    • Adenine, 5'-(dihydrogen phosphate)
    • NCI60_002075
    • SCHEMBL20277555
    • Adenine arabinonucleoside 5'-phosphate
    • 9-.beta.-D-Arabinofuranosyladenine 5'-phosphate
    • Ara-A (phosphate);Adenine Arabinoside (phosphate);9-beta-D-Arabinofuranosyladenine (phosphate)
    • Vidarabine-5'-monophosphate
    • NSC-257884
    • D-Arabinosyladenine 5'-monophosphate
    • L001143
    • CHEMBL16720
    • NS00013345
    • SY035647
    • 122768-03-0
    • 24937-83-5
    • 9H-Purin-6-amine, 9-(5-O-phosphono-.beta.-D-arabinofuranosyl)-
    • Adenine arabinoside 5'-monophosphate
    • FT-0619943
    • Arabinosyladenine monophosphate
    • 31077-38-0
    • 5 inverted exclamation mark -Adenylic Acid
    • WLN: T56 BN DN FN HNJ IZ D- BT5OTJ CQ DQ E1OPQQO
    • 9-.beta.-D-Arabinofuranosyladenine monophosphate
    • NCGC00094831-03
    • [5-(6-Aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxyphosphonic aci d
    • 9-.beta.-D-Arabinofuranosyladenine 5'-monophosphate
    • FT-0696931
    • 9-(5-O-Phosphono-.beta.-D-arabinofuranosyl)-9H-purin-6-amine
    • AKOS025248003
    • NCGC00094831-02
    • Adenine arabinoside monophosphate
    • CHEBI:181501
    • SCHEMBL144997
    • ADENYLIC ACID, YEAST
    • 5'-Arabinosyladenine monophosphate
    • 9-(.beta.-D-Arabinofuranosyl)adenine 5'-(dihydrogen phosphate)
    • NCGC00094831-01
    • FT-0638900
    • Vidarabine (phosphate)
    • NSC257884
    • Inchi： 1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)
    • InChI Key： UDMBCSSLTHHNCD-UHFFFAOYSA-N
    • SMILES： P(=O)(O)(O)OCC1C(C(C(N2C=NC3C(N)=NC=NC2=3)O1)O)O

Computed Properties

  • Exact Mass: 347.06322
  • Monoisotopic Mass: 347.063084
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 4
  • Complexity: 481
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: _3.5
  • Topological Polar Surface Area: 186

Experimental Properties

  • Density: 2.32
  • Boiling Point: 798.5°Cat760mmHg
  • Flash Point: 436.7°C
  • PSA: 186.07
  • LogP: -1.28180

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