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1171924-46-1 | 2-Methoxy-6-(quinolin-8-yloxymethyl)-benzoic acid methyl ester
CAS No: 1171924-46-1 Catalog No: AG00JS5C MDL No:
Product Description
Catalog Number:
AG00JS5C
Chemical Name:
2-Methoxy-6-(quinolin-8-yloxymethyl)-benzoic acid methyl ester
CAS Number:
1171924-46-1
Molecular Formula:
C19H17NO4
Molecular Weight:
323.3426
IUPAC Name:
methyl 2-methoxy-6-(quinolin-8-yloxymethyl)benzoate
InChI:
InChI=1S/C19H17NO4/c1-22-15-9-4-7-14(17(15)19(21)23-2)12-24-16-10-3-6-13-8-5-11-20-18(13)16/h3-11H,12H2,1-2H3
InChI Key:
DGPXCMNFDXZEBP-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(cccc1OC)COc1cccc2c1nccc2
Properties
Complexity:
416
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.116g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.348g/mol
Monoisotopic Mass:
323.116g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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