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107261-17-6 | 2H-1,5-Oxazocine,hexahydro-
CAS No: 107261-17-6 Catalog No: AG007T80 MDL No:
Product Description
Catalog Number:
AG007T80
Chemical Name:
2H-1,5-Oxazocine,hexahydro-
CAS Number:
107261-17-6
Molecular Formula:
C6H13NO
Molecular Weight:
115.1735
IUPAC Name:
1,5-oxazocane
InChI:
InChI=1S/C6H13NO/c1-3-7-4-2-6-8-5-1/h7H,1-6H2
InChI Key:
BMTZFAWRALJMOS-UHFFFAOYSA-N
SMILES:
C1NCCCOCC1
Properties
Complexity:
50.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
115.1g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
115.176g/mol
Monoisotopic Mass:
115.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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