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1545756-20-4 | 4-(BUT-3-EN-1-YL)QUINOLINE
CAS No: 1545756-20-4 Catalog No: AG01DVLR MDL No:MFCD24203554
Product Description
Catalog Number:
AG01DVLR
Chemical Name:
4-(BUT-3-EN-1-YL)QUINOLINE
CAS Number:
1545756-20-4
Molecular Formula:
C13H13N
Molecular Weight:
183.2490
MDL Number:
MFCD24203554
IUPAC Name:
4-but-3-enylquinoline
InChI:
InChI=1S/C13H13N/c1-2-3-6-11-9-10-14-13-8-5-4-7-12(11)13/h2,4-5,7-10H,1,3,6H2
InChI Key:
PDIHXVYAPDJARM-UHFFFAOYSA-N
SMILES:
C=CCCc1ccnc2c1cccc2
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.105g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.254g/mol
Monoisotopic Mass:
183.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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