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cyclooctylmethanamine

CAS No.:
4734-81-0
Catalog Number:
AG01BHL6
Molecular Formula:
C9H19N
Molecular Weight:
141.2539
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Product Description
Catalog Number:
AG01BHL6
Chemical Name:
cyclooctylmethanamine
CAS Number:
4734-81-0
Molecular Formula:
C9H19N
Molecular Weight:
141.2539
MDL Number:
MFCD00154120
IUPAC Name:
cyclooctylmethanamine
InChI:
InChI=1S/C9H19N/c10-8-9-6-4-2-1-3-5-7-9/h9H,1-8,10H2
InChI Key:
GQOIKWAYFXTZOK-UHFFFAOYSA-N
SMILES:
NCC1CCCCCCC1
EC Number:
225-244-7
Properties
Complexity:
72.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.152g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
141.258g/mol
Monoisotopic Mass:
141.152g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Literature
Title Journal
A new synthetic approach to 1-[(3R,4R)-1-cyclooctylmethyl-3-hydroxymethyl-4-piperidyl]-3-ethyl-1,3-dihydro-benzimidazol-2-one(J-113397), the first non-peptide ORL-1 receptor antagonist. Bioorganic & medicinal chemistry 20010701
Properties