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102433-19-2 | Thiourea, N-(2,2-diethoxyethyl)-N-methyl-N'-1-naphthalenyl-
CAS No: 102433-19-2 Catalog No: AG0007GX MDL No:
Product Description
Catalog Number:
AG0007GX
Chemical Name:
Thiourea, N-(2,2-diethoxyethyl)-N-methyl-N'-1-naphthalenyl-
CAS Number:
102433-19-2
Molecular Formula:
C18H24N2O2S
Molecular Weight:
332.4604
IUPAC Name:
1-(2,2-diethoxyethyl)-1-methyl-3-naphthalen-1-ylthiourea
InChI:
InChI=1S/C18H24N2O2S/c1-4-21-17(22-5-2)13-20(3)18(23)19-16-12-8-10-14-9-6-7-11-15(14)16/h6-12,17H,4-5,13H2,1-3H3,(H,19,23)
InChI Key:
IXOQSAYPBNELSM-UHFFFAOYSA-N
SMILES:
CCOC(CN(C(=S)Nc1cccc2c1cccc2)C)OCC
NSC Number:
659201
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.156g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
332.462g/mol
Monoisotopic Mass:
332.156g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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