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20421-35-6 | Propanoic acid, 2-(4-chlorophenoxy)-, (2S)-
CAS No: 20421-35-6 Catalog No: AG0029CN MDL No:MFCD24479545
Product Description
Catalog Number:
AG0029CN
Chemical Name:
Propanoic acid, 2-(4-chlorophenoxy)-, (2S)-
CAS Number:
20421-35-6
Molecular Formula:
C9H9ClO3
Molecular Weight:
200.6190
MDL Number:
MFCD24479545
IUPAC Name:
(2S)-2-(4-chlorophenoxy)propanoic acid
InChI:
InChI=1S/C9H9ClO3/c1-6(9(11)12)13-8-4-2-7(10)3-5-8/h2-6H,1H3,(H,11,12)/t6-/m0/s1
InChI Key:
DKHJWWRYTONYHB-LURJTMIESA-N
SMILES:
C[C@@H](C(=O)O)Oc1ccc(cc1)Cl
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
200.024g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.618g/mol
Monoisotopic Mass:
200.024g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| Antiviral activity of antilipidemic compounds on herpes simplex virus type 1. | Antimicrobial agents and chemotherapy 19800801 |
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