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50610-82-7 | 2-benzyl-1,2,3,4-tetrahydroquinoline
CAS No: 50610-82-7 Catalog No: AG01EHWA MDL No:MFCD20943008
Product Description
Catalog Number:
AG01EHWA
Chemical Name:
2-benzyl-1,2,3,4-tetrahydroquinoline
CAS Number:
50610-82-7
Molecular Formula:
C16H17N
Molecular Weight:
223.3129
MDL Number:
MFCD20943008
IUPAC Name:
2-benzyl-1,2,3,4-tetrahydroquinoline
InChI:
InChI=1S/C16H17N/c1-2-6-13(7-3-1)12-15-11-10-14-8-4-5-9-16(14)17-15/h1-9,15,17H,10-12H2
InChI Key:
QEYCTWCXRNTSEP-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CC1CCc2c(N1)cccc2
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.136g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
223.319g/mol
Monoisotopic Mass:
223.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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