Home Other Building Blocks 2-((4-Chlorophenyl)thio)-2-methylpropanal

2-((4-Chlorophenyl)thio)-2-methylpropanal

CAS No.:
56421-90-0
Catalog Number:
AG00EA3A
Molecular Formula:
C10H11ClOS
Molecular Weight:
214.7117
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$337
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Product Description
Catalog Number:
AG00EA3A
Chemical Name:
2-((4-Chlorophenyl)thio)-2-methylpropanal
CAS Number:
56421-90-0
Molecular Formula:
C10H11ClOS
Molecular Weight:
214.7117
MDL Number:
MFCD00243426
IUPAC Name:
2-(4-chlorophenyl)sulfanyl-2-methylpropanal
InChI:
InChI=1S/C10H11ClOS/c1-10(2,7-12)13-9-5-3-8(11)4-6-9/h3-7H,1-2H3
InChI Key:
ATFFNOSBGHNMPY-UHFFFAOYSA-N
SMILES:
O=CC(Sc1ccc(cc1)Cl)(C)C
Properties
Complexity:
174  
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties