Home Other Building Blocks 2-cyclopentyl-1-(2,3-dihydro-1,4-benzodioxin-2-yl)ethan-1-amine

2-cyclopentyl-1-(2,3-dihydro-1,4-benzodioxin-2-yl)ethan-1-amine

CAS No.:
1483159-28-9
Catalog Number:
AG01B812
Molecular Formula:
C15H21NO2
Molecular Weight:
247.3327
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Product Description
Catalog Number:
AG01B812
Chemical Name:
2-cyclopentyl-1-(2,3-dihydro-1,4-benzodioxin-2-yl)ethan-1-amine
CAS Number:
1483159-28-9
Molecular Formula:
C15H21NO2
Molecular Weight:
247.3327
MDL Number:
MFCD20795777
IUPAC Name:
2-cyclopentyl-1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethanamine
InChI:
InChI=1S/C15H21NO2/c16-12(9-11-5-1-2-6-11)15-10-17-13-7-3-4-8-14(13)18-15/h3-4,7-8,11-12,15H,1-2,5-6,9-10,16H2
InChI Key:
LMRBOUFAOSVJNQ-UHFFFAOYSA-N
SMILES:
NC(C1COc2c(O1)cccc2)CC1CCCC1
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.157g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
247.338g/mol
Monoisotopic Mass:
247.157g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties