Home Halogens [1-(2,4-dichlorophenyl)ethyl]thiourea

[1-(2,4-dichlorophenyl)ethyl]thiourea

CAS No.:
1152515-60-0
Catalog Number:
AG01AAWE
Molecular Formula:
C9H10Cl2N2S
Molecular Weight:
249.1601
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Product Description
Catalog Number:
AG01AAWE
Chemical Name:
[1-(2,4-dichlorophenyl)ethyl]thiourea
CAS Number:
1152515-60-0
Molecular Formula:
C9H10Cl2N2S
Molecular Weight:
249.1601
MDL Number:
MFCD10688722
IUPAC Name:
1-(2,4-dichlorophenyl)ethylthiourea
InChI:
InChI=1S/C9H10Cl2N2S/c1-5(13-9(12)14)7-3-2-6(10)4-8(7)11/h2-5H,1H3,(H3,12,13,14)
InChI Key:
TZOJBQPAHVWAOP-UHFFFAOYSA-N
SMILES:
NC(=S)NC(c1ccc(cc1Cl)Cl)C
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.994g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
249.153g/mol
Monoisotopic Mass:
247.994g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties