Home Halogens (2-chloro-4-methylphenyl)thiourea

(2-chloro-4-methylphenyl)thiourea

CAS No.:
57005-14-8
Catalog Number:
AG01C2MM
Molecular Formula:
C8H9ClN2S
Molecular Weight:
200.6885
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Product Description
Catalog Number:
AG01C2MM
Chemical Name:
(2-chloro-4-methylphenyl)thiourea
CAS Number:
57005-14-8
Molecular Formula:
C8H9ClN2S
Molecular Weight:
200.6885
MDL Number:
MFCD00060432
IUPAC Name:
(2-chloro-4-methylphenyl)thiourea
InChI:
InChI=1S/C8H9ClN2S/c1-5-2-3-7(6(9)4-5)11-8(10)12/h2-4H,1H3,(H3,10,11,12)
InChI Key:
GNNRBIUCWVOVQD-UHFFFAOYSA-N
SMILES:
NC(=S)Nc1ccc(cc1Cl)C
NSC Number:
523949
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.017g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
200.684g/mol
Monoisotopic Mass:
200.017g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties