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Home > Pyridines > 1909295-00-6
1909295-00-6 | rac-(4aS,8aR)-hexahydro-2H-pyrido[4,3-b][1,4]oxazin-3(4H)-one dihydrochloride
CAS No: 1909295-00-6 Catalog No: AG00J39L MDL No:MFCD29127457
Product Description
Catalog Number:
AG00J39L
Chemical Name:
rac-(4aS,8aR)-hexahydro-2H-pyrido[4,3-b][1,4]oxazin-3(4H)-one dihydrochloride
CAS Number:
1909295-00-6
Molecular Formula:
C7H14Cl2N2O2
Molecular Weight:
229.1043
MDL Number:
MFCD29127457
IUPAC Name:
(4aS,8aR)-4a,5,6,7,8,8a-hexahydro-4H-pyrido[4,3-b][1,4]oxazin-3-one;dihydrochloride
InChI:
InChI=1S/C7H12N2O2.2ClH/c10-7-4-11-6-1-2-8-3-5(6)9-7;;/h5-6,8H,1-4H2,(H,9,10);2*1H/t5-,6+;;/m0../s1
InChI Key:
SVLXXPTVOWLLEY-KXSOTYCDSA-N
SMILES:
O=C1CO[C@H]2[C@@H](N1)CNCC2.Cl.Cl
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
228.043g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
229.101g/mol
Monoisotopic Mass:
228.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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