Home Other Building Blocks ethyl (1,2,3,4-tetrahydroquinolin-2-yl)acetate

ethyl (1,2,3,4-tetrahydroquinolin-2-yl)acetate

CAS No.:
5100-58-3
Catalog Number:
AG01E71O
Molecular Formula:
C13H17NO2
Molecular Weight:
219.2796
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Product Description
Catalog Number:
AG01E71O
Chemical Name:
ethyl (1,2,3,4-tetrahydroquinolin-2-yl)acetate
CAS Number:
5100-58-3
Molecular Formula:
C13H17NO2
Molecular Weight:
219.2796
MDL Number:
MFCD11707093
IUPAC Name:
ethyl 2-(1,2,3,4-tetrahydroquinolin-2-yl)acetate
InChI:
InChI=1S/C13H17NO2/c1-2-16-13(15)9-11-8-7-10-5-3-4-6-12(10)14-11/h3-6,11,14H,2,7-9H2,1H3
InChI Key:
IYOKFCOGEPFIKG-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC1CCc2c(N1)cccc2
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.126g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
219.284g/mol
Monoisotopic Mass:
219.126g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties