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883498-52-0 | S-(2-Chloropropionyl)-p-mercaptotoluene
CAS No: 883498-52-0 Catalog No: AG01FO4E MDL No:
Product Description
Catalog Number:
AG01FO4E
Chemical Name:
S-(2-Chloropropionyl)-p-mercaptotoluene
CAS Number:
883498-52-0
IUPAC Name:
S-(4-methylphenyl) 2-chloropropanethioate
InChI:
InChI=1S/C10H11ClOS/c1-7-3-5-9(6-4-7)13-10(12)8(2)11/h3-6,8H,1-2H3
InChI Key:
YZFIEIFBYLSJEJ-UHFFFAOYSA-N
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.022g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.707g/mol
Monoisotopic Mass:
214.022g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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