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110259-96-6 | Quinoline, 1-dodecyl-1,2,3,4-tetrahydro-
CAS No: 110259-96-6 Catalog No: AG007DR9 MDL No:
Product Description
Catalog Number:
AG007DR9
Chemical Name:
Quinoline, 1-dodecyl-1,2,3,4-tetrahydro-
CAS Number:
110259-96-6
Molecular Formula:
C21H35N
Molecular Weight:
301.5093
IUPAC Name:
1-dodecyl-3,4-dihydro-2H-quinoline
InChI:
InChI=1S/C21H35N/c1-2-3-4-5-6-7-8-9-10-13-18-22-19-14-16-20-15-11-12-17-21(20)22/h11-12,15,17H,2-10,13-14,16,18-19H2,1H3
InChI Key:
BZFIRYYQHGARKG-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCN1CCCc2c1cccc2
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.277g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.518g/mol
Monoisotopic Mass:
301.277g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8
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