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1020349-31-8 | 3H-Oxazolo[3,4-a]pyrazin-3-one, hexahydro-, hydrochloride (1:1)
CAS No: 1020349-31-8 Catalog No: AG0006F7 MDL No:MFCD09878828
Product Description
Catalog Number:
AG0006F7
Chemical Name:
3H-Oxazolo[3,4-a]pyrazin-3-one, hexahydro-, hydrochloride (1:1)
CAS Number:
1020349-31-8
Molecular Formula:
C6H11ClN2O2
Molecular Weight:
178.6167
MDL Number:
MFCD09878828
IUPAC Name:
1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazin-3-one;hydrochloride
InChI:
InChI=1S/C6H10N2O2.ClH/c9-6-8-2-1-7-3-5(8)4-10-6;/h5,7H,1-4H2;1H
InChI Key:
NEFDJLDMYYSLHW-UHFFFAOYSA-N
SMILES:
O=C1OCC2N1CCNC2.Cl
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.051g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
178.616g/mol
Monoisotopic Mass:
178.051g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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