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29146-05-2 | 2,6-Dioxa-4,8-diazatricyclo[3.3.1.13,7]decane (9CI)
CAS No: 29146-05-2 Catalog No: AG002XGJ MDL No:
Product Description
Catalog Number:
AG002XGJ
Chemical Name:
2,6-Dioxa-4,8-diazatricyclo[3.3.1.13,7]decane (9CI)
CAS Number:
29146-05-2
Molecular Formula:
C6H10N2O2
Molecular Weight:
142.1558
IUPAC Name:
2,6-dioxa-4,8-diazatricyclo[3.3.1.13,7]decane
InChI:
InChI=1S/C6H10N2O2/c1-3-7-5-2-6(9-3)8-4(1)10-5/h3-8H,1-2H2
InChI Key:
JCPYHUMUISMDFN-UHFFFAOYSA-N
SMILES:
C1C2NC3OC1NC(O2)C3
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.074g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
142.158g/mol
Monoisotopic Mass:
142.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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