200,000+ products from a single source!
sales@angenechem.com
122305-66-2 | Propanoic acid, 2-[[(4-chlorophenyl)methyl]thio]-
CAS No: 122305-66-2 Catalog No: AG00173C MDL No:MFCD04070622
Product Description
Catalog Number:
AG00173C
Chemical Name:
Propanoic acid, 2-[[(4-chlorophenyl)methyl]thio]-
CAS Number:
122305-66-2
Molecular Formula:
C10H11ClO2S
Molecular Weight:
230.7111
MDL Number:
MFCD04070622
IUPAC Name:
2-[(4-chlorophenyl)methylsulfanyl]propanoic acid
InChI:
InChI=1S/C10H11ClO2S/c1-7(10(12)13)14-6-8-2-4-9(11)5-3-8/h2-5,7H,6H2,1H3,(H,12,13)
InChI Key:
KUNWCLBBXUZVJX-UHFFFAOYSA-N
SMILES:
CC(C(=O)O)SCc1ccc(cc1)Cl
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.017g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.706g/mol
Monoisotopic Mass:
230.017g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.