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877201-35-9 | Spiro[2.5]octan-6-ylmethanamine
CAS No: 877201-35-9 Catalog No: AG004JCB MDL No:MFCD11501146
Product Description
Catalog Number:
AG004JCB
Chemical Name:
Spiro[2.5]octan-6-ylmethanamine
CAS Number:
877201-35-9
Molecular Formula:
C9H17N
Molecular Weight:
139.2380
MDL Number:
MFCD11501146
IUPAC Name:
spiro[2.5]octan-6-ylmethanamine
InChI:
InChI=1S/C9H17N/c10-7-8-1-3-9(4-2-8)5-6-9/h8H,1-7,10H2
InChI Key:
JEDATJQHUZRDBE-UHFFFAOYSA-N
SMILES:
NCC1CCC2(CC1)CC2
Properties
Complexity:
117
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.136g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
139.242g/mol
Monoisotopic Mass:
139.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| 4-Amino-2-cyanopyrimidines: novel scaffold for nonpeptidic cathepsin S inhibitors. | Bioorganic & medicinal chemistry letters 20080815 |
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