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1516-38-7 | Thiourea, N-(2-ethoxyphenyl)-
CAS No: 1516-38-7 Catalog No: AG001NFN MDL No:MFCD00060433
Product Description
Catalog Number:
AG001NFN
Chemical Name:
Thiourea, N-(2-ethoxyphenyl)-
CAS Number:
1516-38-7
Molecular Formula:
C9H12N2OS
Molecular Weight:
196.2694
MDL Number:
MFCD00060433
IUPAC Name:
(2-ethoxyphenyl)thiourea
InChI:
InChI=1S/C9H12N2OS/c1-2-12-8-6-4-3-5-7(8)11-9(10)13/h3-6H,2H2,1H3,(H3,10,11,13)
InChI Key:
VUWYZMBGSSVKLN-UHFFFAOYSA-N
SMILES:
CCOc1ccccc1NC(=S)N
NSC Number:
31197
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.268g/mol
Monoisotopic Mass:
196.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
79.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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