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100180-96-9 | 2H-Pyrazino[2,3-b]-1,4-oxazine, octahydro-4,5,8-trimethyl-
CAS No: 100180-96-9 Catalog No: AG000169 MDL No:MFCD27958307
Product Description
Catalog Number:
AG000169
Chemical Name:
2H-Pyrazino[2,3-b]-1,4-oxazine, octahydro-4,5,8-trimethyl-
CAS Number:
100180-96-9
Molecular Formula:
C9H19N3O
Molecular Weight:
185.2667
MDL Number:
MFCD27958307
IUPAC Name:
4,5,8-trimethyl-2,3,4a,6,7,8a-hexahydropyrazino[2,3-b][1,4]oxazine
InChI:
InChI=1S/C9H19N3O/c1-10-4-5-12(3)9-8(10)11(2)6-7-13-9/h8-9H,4-7H2,1-3H3
InChI Key:
MHVSUWFOZGBLGK-UHFFFAOYSA-N
SMILES:
CN1CCN(C2C1OCCN2C)C
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.153g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.271g/mol
Monoisotopic Mass:
185.153g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
19A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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