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1142-30-9 | Thiourea, N-(4-ethoxyphenyl)-N'-2-propen-1-yl-
CAS No: 1142-30-9 Catalog No: AG000ASM MDL No:
Product Description
Catalog Number:
AG000ASM
Chemical Name:
Thiourea, N-(4-ethoxyphenyl)-N'-2-propen-1-yl-
CAS Number:
1142-30-9
Molecular Formula:
C12H16N2OS
Molecular Weight:
236.3332
IUPAC Name:
1-(4-ethoxyphenyl)-3-prop-2-enylthiourea
InChI:
InChI=1S/C12H16N2OS/c1-3-9-13-12(16)14-10-5-7-11(8-6-10)15-4-2/h3,5-8H,1,4,9H2,2H3,(H2,13,14,16)
InChI Key:
JUYGRDKXJBNWHN-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)NC(=S)NCC=C
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.098g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.333g/mol
Monoisotopic Mass:
236.098g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
65.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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