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1016689-69-2 | tert-butyl N-(8-methyl-1,2,3,4-tetrahydroquinolin-5-yl)carbamate
CAS No: 1016689-69-2 Catalog No: AG01A5WU MDL No:MFCD09808194
Product Description
Catalog Number:
AG01A5WU
Chemical Name:
tert-butyl N-(8-methyl-1,2,3,4-tetrahydroquinolin-5-yl)carbamate
CAS Number:
1016689-69-2
Molecular Formula:
C15H22N2O2
Molecular Weight:
262.3474
MDL Number:
MFCD09808194
IUPAC Name:
tert-butyl N-(8-methyl-1,2,3,4-tetrahydroquinolin-5-yl)carbamate
InChI:
InChI=1S/C15H22N2O2/c1-10-7-8-12(11-6-5-9-16-13(10)11)17-14(18)19-15(2,3)4/h7-8,16H,5-6,9H2,1-4H3,(H,17,18)
InChI Key:
ZFVPOHVXQAUDCR-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc(c2c1CCCN2)C
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.168g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
262.353g/mol
Monoisotopic Mass:
262.168g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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