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14521-38-1 | 4H-Phospholo[3,4-d]isoxazole
CAS No: 14521-38-1 Catalog No: AG001KOJ MDL No:
Product Description
Catalog Number:
AG001KOJ
Chemical Name:
4H-Phospholo[3,4-d]isoxazole
CAS Number:
14521-38-1
Molecular Formula:
C5H4NOP
Molecular Weight:
125.0651
IUPAC Name:
4H-phospholo[3,4-d][1,2]oxazole
InChI:
InChI=1S/C5H4NOP/c1-4-2-8-3-5(4)7-6-1/h1,3H,2H2
InChI Key:
HJKWPZNUOSCJJI-UHFFFAOYSA-N
SMILES:
n1cc2c(o1)C=PC2
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.003g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
125.067g/mol
Monoisotopic Mass:
125.003g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
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