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115519-84-1 | 1,3,5-Triazatricyclo[3.3.1.13,7]decan-2-amine
CAS No: 115519-84-1 Catalog No: AG000G3S MDL No:
Product Description
Catalog Number:
AG000G3S
Chemical Name:
1,3,5-Triazatricyclo[3.3.1.13,7]decan-2-amine
CAS Number:
115519-84-1
Molecular Formula:
C7H14N4
Molecular Weight:
154.2129
IUPAC Name:
1,3,5-triazatricyclo[3.3.1.13,7]decan-2-amine
InChI:
InChI=1S/C7H14N4/c8-7-10-2-6-1-9(4-10)5-11(7)3-6/h6-7H,1-5,8H2
InChI Key:
CBPRCIJFMJMLQV-UHFFFAOYSA-N
SMILES:
NC1N2CC3CN1CN(C2)C3
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.122g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.217g/mol
Monoisotopic Mass:
154.122g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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