Home Carboxys tert-butyl 1,2,3,4-tetrahydroquinoline-6-carboxylate

tert-butyl 1,2,3,4-tetrahydroquinoline-6-carboxylate

CAS No.:
878291-94-2
Catalog Number:
AG01C2YJ
Molecular Formula:
C14H19NO2
Molecular Weight:
233.3062
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Product Description
Catalog Number:
AG01C2YJ
Chemical Name:
tert-butyl 1,2,3,4-tetrahydroquinoline-6-carboxylate
CAS Number:
878291-94-2
Molecular Formula:
C14H19NO2
Molecular Weight:
233.3062
MDL Number:
MFCD12871935
IUPAC Name:
tert-butyl 1,2,3,4-tetrahydroquinoline-6-carboxylate
InChI:
InChI=1S/C14H19NO2/c1-14(2,3)17-13(16)11-6-7-12-10(9-11)5-4-8-15-12/h6-7,9,15H,4-5,8H2,1-3H3
InChI Key:
QEXLWTVSUXSGEQ-UHFFFAOYSA-N
SMILES:
O=C(c1ccc2c(c1)CCCN2)OC(C)(C)C
Properties
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.142g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.311g/mol
Monoisotopic Mass:
233.142g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties