Cas no 123920-06-9 (b-allo-2-Octulopyranose,2,7-anhydro-1,4,8-trideoxy-5-O-(phenylmethyl)- (9CI))

b-allo-2-Octulopyranose,2,7-anhydro-1,4,8-trideoxy-5-O-(phenylmethyl)- (9CI) structure
123920-06-9 structure
Product Name:b-allo-2-Octulopyranose,2,7-anhydro-1,4,8-trideoxy-5-O-(phenylmethyl)- (9CI)
CAS No:123920-06-9
MF:C7H8N2
MW:120.151821136475
CID:104345
PubChem ID:2332
Update Time:2025-04-18

b-allo-2-Octulopyranose,2,7-anhydro-1,4,8-trideoxy-5-O-(phenylmethyl)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • b-allo-2-Octulopyranose,2,7-anhydro-1,4,8-trideoxy-5-O-(phenylmethyl)- (9CI)
    • .beta.-allo-2-Octulopyranose, 2,7-anhydro-1,4,8-trideoxy-5-O-(phenylmethyl)-
    • NCGC00015160-04
    • NSC 243704
    • Lopac-B-6506
    • 1c5o
    • 1ce5
    • Q4890748
    • BDBM50038002
    • BS-3750
    • AMY31187
    • 1j16
    • EINECS 210-546-3
    • Lopac0_000203
    • 1f5k
    • NCGC00015160-02
    • CHEBI:41033
    • NCGC00015160-03
    • CCRIS 2952
    • SDCCGSBI-0050191.P002
    • BEN
    • KUE3ZY3J1F
    • C01784
    • AKOS000201384
    • 1v2m
    • 1v2j
    • CS-0103011
    • AE-641/30119009
    • Q-100255
    • NCGC00015160-07
    • 1v2l
    • MFCD00042826
    • 64F5C29D-34E7-4815-B5F3-CC94EA3D2CAD
    • Benzamidinium chloride
    • 1j14
    • F1905-7123
    • NS00000060
    • AB00691669-14
    • 618-39-3
    • UNII-KUE3ZY3J1F
    • 123920-06-9
    • benzamidine
    • 125772-71-6
    • 1w80
    • 1c5p
    • 1oss
    • Benzenecarboxamidine
    • FT-0694841
    • SCHEMBL9207
    • 1bra
    • MLS001066369
    • HMS2233B11
    • CCG-204298
    • 2ast
    • 1c5z
    • 1v2v
    • AB01943
    • 1v2u
    • SMR000471900
    • SY096666
    • 1j15
    • 1h4w
    • A852076
    • NCGC00162090-01
    • Benzamidine (Protonated)
    • GTPL7566
    • CHEMBL20936
    • Phenylamidine
    • 1v2s
    • NSC243704
    • NCGC00015160-05
    • Benzenecarboximidamide
    • 2j9n
    • DTXSID8045012
    • NSC-243704
    • Benzimidamide
    • HMS3370L08
    • NCGC00015160-01
    • BenzaMidine;Benzimidamide
    • Inchi： 1S/C7H8N2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H3,8,9)
    • InChI Key： PXXJHWLDUBFPOL-UHFFFAOYSA-N
    • SMILES： NC(C1C=CC=CC=1)=N

Computed Properties

  • Exact Mass: 120.068748264g/mol
  • Monoisotopic Mass: 120.068748264g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 11
  • Heavy Atom Count: 37
  • Rotatable Bond Count: 9
  • Complexity: 1010
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 49.9?2
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 2.2

b-allo-2-Octulopyranose,2,7-anhydro-1,4,8-trideoxy-5-O-(phenylmethyl)- (9CI) Related Literature

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