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263149-09-3 | Benzoic acid, 2-[[(dimethylamino)methylene]amino]-5-methoxy-4-(phenylmethoxy)-, methyl ester
CAS No: 263149-09-3 Catalog No: AG002SOI MDL No:
Product Description
Catalog Number:
AG002SOI
Chemical Name:
Benzoic acid, 2-[[(dimethylamino)methylene]amino]-5-methoxy-4-(phenylmethoxy)-, methyl ester
CAS Number:
263149-09-3
Molecular Formula:
C19H22N2O4
Molecular Weight:
342.3890
IUPAC Name:
methyl 2-(dimethylaminomethylideneamino)-5-methoxy-4-phenylmethoxybenzoate
InChI:
InChI=1S/C19H22N2O4/c1-21(2)13-20-16-11-18(25-12-14-8-6-5-7-9-14)17(23-3)10-15(16)19(22)24-4/h5-11,13H,12H2,1-4H3
InChI Key:
WIUQTTCGYDCFAS-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(OC)c(cc1N=CN(C)C)OCc1ccccc1
Properties
Complexity:
435
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.158g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
342.395g/mol
Monoisotopic Mass:
342.158g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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