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Home > Pyridines > 875138-41-3
875138-41-3 | 1-hydroxy-1H,2H,4H,5H,6H,7H,7aH-1lambda5-phospholo[3,2-c]pyridin-1-one
CAS No: 875138-41-3 Catalog No: AG01C5QU MDL No:MFCD20690018
Product Description
Catalog Number:
AG01C5QU
Chemical Name:
1-hydroxy-1H,2H,4H,5H,6H,7H,7aH-1lambda5-phospholo[3,2-c]pyridin-1-one
CAS Number:
875138-41-3
Molecular Formula:
C7H12NO2P
Molecular Weight:
173.1494
MDL Number:
MFCD20690018
IUPAC Name:
1-hydroxy-2,4,5,6,7,7a-hexahydrophospholo[3,2-c]pyridine 1-oxide
InChI:
InChI=1S/C7H12NO2P/c9-11(10)4-2-6-5-8-3-1-7(6)11/h2,7-8H,1,3-5H2,(H,9,10)
InChI Key:
JREBXXJUKMIHDU-UHFFFAOYSA-N
SMILES:
OP1(=O)CC=C2C1CCNC2
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.061g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
173.152g/mol
Monoisotopic Mass:
173.061g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-4.1
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