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Home > Aldehydes > 1255188-94-3
1255188-94-3 | 3-Thiophenecarboxaldehyde, 2-(2-chlorophenyl)-2,5-dihydro-, (2S)-
CAS No: 1255188-94-3 Catalog No: AG000NT4 MDL No:
Product Description
Catalog Number:
AG000NT4
Chemical Name:
3-Thiophenecarboxaldehyde, 2-(2-chlorophenyl)-2,5-dihydro-, (2S)-
CAS Number:
1255188-94-3
Molecular Formula:
C11H9ClOS
Molecular Weight:
224.7066
IUPAC Name:
(2S)-2-(2-chlorophenyl)-2,5-dihydrothiophene-3-carbaldehyde
InChI:
InChI=1S/C11H9ClOS/c12-10-4-2-1-3-9(10)11-8(7-13)5-6-14-11/h1-5,7,11H,6H2/t11-/m0/s1
InChI Key:
QAENQZWLPYZECK-NSHDSACASA-N
SMILES:
O=CC1=CCS[C@@H]1c1ccccc1Cl
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
224.006g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.702g/mol
Monoisotopic Mass:
224.006g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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