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65442-31-1 | 6-sec-butylquinoline
CAS No: 65442-31-1 Catalog No: AG00ECTF MDL No:
Product Description
Catalog Number:
AG00ECTF
Chemical Name:
6-sec-butylquinoline
CAS Number:
65442-31-1
IUPAC Name:
6-butan-2-ylquinoline
InChI:
InChI=1S/C13H15N/c1-3-10(2)11-6-7-13-12(9-11)5-4-8-14-13/h4-10H,3H2,1-2H3
InChI Key:
AUBLFWWZTFFBNU-UHFFFAOYSA-N
EC Number:
265-777-2
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.12g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
185.27g/mol
Monoisotopic Mass:
185.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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