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10222-61-4 | 4-Quinolinecarboxylic acid, 2-butoxy-
CAS No: 10222-61-4 Catalog No: AG0006YY MDL No:MFCD11527607
Product Description
Catalog Number:
AG0006YY
Chemical Name:
4-Quinolinecarboxylic acid, 2-butoxy-
CAS Number:
10222-61-4
Molecular Formula:
C14H15NO3
Molecular Weight:
245.2738
MDL Number:
MFCD11527607
IUPAC Name:
2-butoxyquinoline-4-carboxylic acid
InChI:
InChI=1S/C14H15NO3/c1-2-3-8-18-13-9-11(14(16)17)10-6-4-5-7-12(10)15-13/h4-7,9H,2-3,8H2,1H3,(H,16,17)
InChI Key:
ZISCTCXYESUBGA-UHFFFAOYSA-N
SMILES:
CCCCOc1nc2ccccc2c(c1)C(=O)O
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.105g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.278g/mol
Monoisotopic Mass:
245.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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