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634-27-5 | pyridoxal-5-phosphate semicarbazone
CAS No: 634-27-5 Catalog No: AG00F32K MDL No:
Product Description
Catalog Number:
AG00F32K
Chemical Name:
pyridoxal-5-phosphate semicarbazone
CAS Number:
634-27-5
IUPAC Name:
[4-[(E)-(carbamoylhydrazinylidene)methyl]-5-hydroxy-6-methylpyridin-3-yl]methyl dihydrogen phosphate
InChI:
InChI=1S/C9H13N4O6P/c1-5-8(14)7(3-12-13-9(10)15)6(2-11-5)4-19-20(16,17)18/h2-3,14H,4H2,1H3,(H3,10,13,15)(H2,16,17,18)/b12-3+
InChI Key:
CGMJEDXHHYDXER-KGVSQERTSA-N
Properties
Complexity:
413
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
304.057g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
304.199g/mol
Monoisotopic Mass:
304.057g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
167A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.4
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