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Home > Pyridines > 1955540-27-8
1955540-27-8 | 1-hydroxy-1H,2H,4H,5H,6H,7H,7aH-1lambda5-phospholo[3,2-c]pyridin-1-one hydrochloride
CAS No: 1955540-27-8 Catalog No: AG01C5QT MDL No:MFCD29907097
Product Description
Catalog Number:
AG01C5QT
Chemical Name:
1-hydroxy-1H,2H,4H,5H,6H,7H,7aH-1lambda5-phospholo[3,2-c]pyridin-1-one hydrochloride
CAS Number:
1955540-27-8
Molecular Formula:
C7H13ClNO2P
Molecular Weight:
209.6104
MDL Number:
MFCD29907097
IUPAC Name:
1-hydroxy-2,4,5,6,7,7a-hexahydrophospholo[3,2-c]pyridine 1-oxide;hydrochloride
InChI:
InChI=1S/C7H12NO2P.ClH/c9-11(10)4-2-6-5-8-3-1-7(6)11;/h2,7-8H,1,3-5H2,(H,9,10);1H
InChI Key:
SLQISBHFBXNHCK-UHFFFAOYSA-N
SMILES:
OP1(=O)CC=C2C1CCNC2.Cl
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.037g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
209.61g/mol
Monoisotopic Mass:
209.037g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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