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24827-37-0 | Thiourea, N-[(4-chlorophenyl)methyl]-
CAS No: 24827-37-0 Catalog No: AG002PKT MDL No:MFCD00060466
Product Description
Catalog Number:
AG002PKT
Chemical Name:
Thiourea, N-[(4-chlorophenyl)methyl]-
CAS Number:
24827-37-0
Molecular Formula:
C8H9ClN2S
Molecular Weight:
200.6885
MDL Number:
MFCD00060466
IUPAC Name:
(4-chlorophenyl)methylthiourea
InChI:
InChI=1S/C8H9ClN2S/c9-7-3-1-6(2-4-7)5-11-8(10)12/h1-4H,5H2,(H3,10,11,12)
InChI Key:
CRHPDONOCLCOOR-UHFFFAOYSA-N
SMILES:
NC(=S)NCc1ccc(cc1)Cl
Properties
Complexity:
155
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:
2
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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