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1171924-37-0 | 2-Methoxy-6-(quinolin-8-yloxymethyl)-benzoic acid ethyl ester
CAS No: 1171924-37-0 Catalog No: AG00JS4Z MDL No:MFCD12546784
Product Description
Catalog Number:
AG00JS4Z
Chemical Name:
2-Methoxy-6-(quinolin-8-yloxymethyl)-benzoic acid ethyl ester
CAS Number:
1171924-37-0
Molecular Formula:
C20H19NO4
Molecular Weight:
337.3692
MDL Number:
MFCD12546784
IUPAC Name:
ethyl 2-methoxy-6-(quinolin-8-yloxymethyl)benzoate
InChI:
InChI=1S/C20H19NO4/c1-3-24-20(22)18-15(8-5-10-16(18)23-2)13-25-17-11-4-7-14-9-6-12-21-19(14)17/h4-12H,3,13H2,1-2H3
InChI Key:
OPVNZFLSIGLURJ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(cccc1OC)COc1cccc2c1nccc2
Properties
Complexity:
430
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.131g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.375g/mol
Monoisotopic Mass:
337.131g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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