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22493-93-2 | Quinoline, 2-(1-methylpropyl)-
CAS No: 22493-93-2 Catalog No: AG006XS6 MDL No:MFCD28337276
Product Description
Catalog Number:
AG006XS6
Chemical Name:
Quinoline, 2-(1-methylpropyl)-
CAS Number:
22493-93-2
Molecular Formula:
C13H15N
Molecular Weight:
185.2649
MDL Number:
MFCD28337276
IUPAC Name:
2-butan-2-ylquinoline
InChI:
InChI=1S/C13H15N/c1-3-10(2)12-9-8-11-6-4-5-7-13(11)14-12/h4-10H,3H2,1-2H3
InChI Key:
DGOZIOPKJJGGLJ-UHFFFAOYSA-N
SMILES:
CCC(c1ccc2c(n1)cccc2)C
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:
3.7
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