Home Other Building Blocks (5-phenyloxolan-2-yl)methanamine

(5-phenyloxolan-2-yl)methanamine

CAS No.:
878661-56-4
Catalog Number:
AG01A20L
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
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Product Description
Catalog Number:
AG01A20L
Chemical Name:
(5-phenyloxolan-2-yl)methanamine
CAS Number:
878661-56-4
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
MDL Number:
MFCD20702083
IUPAC Name:
(5-phenyloxolan-2-yl)methanamine
InChI:
InChI=1S/C11H15NO/c12-8-10-6-7-11(13-10)9-4-2-1-3-5-9/h1-5,10-11H,6-8,12H2
InChI Key:
IAIACGGIZWXQIK-UHFFFAOYSA-N
SMILES:
NCC1CCC(O1)c1ccccc1
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.115g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.247g/mol
Monoisotopic Mass:
177.115g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
2,5-Disubstituted tetrahydrofurans as selective serotonin re-uptake inhibitors. Bioorganic & medicinal chemistry 20090301
Properties