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2089996-24-5 | 4-(3-chlorophenyl)thiophene-3-carbaldehyde
CAS No: 2089996-24-5 Catalog No: AG01CA0I MDL No:MFCD31456491
Product Description
Catalog Number:
AG01CA0I
Chemical Name:
4-(3-chlorophenyl)thiophene-3-carbaldehyde
CAS Number:
2089996-24-5
Molecular Formula:
C11H7ClOS
Molecular Weight:
222.6907
MDL Number:
MFCD31456491
IUPAC Name:
4-(3-chlorophenyl)thiophene-3-carbaldehyde
InChI:
InChI=1S/C11H7ClOS/c12-10-3-1-2-8(4-10)11-7-14-6-9(11)5-13/h1-7H
InChI Key:
HOWZKFHBDUGZAS-UHFFFAOYSA-N
SMILES:
O=Cc1cscc1c1cccc(c1)Cl
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.991g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.686g/mol
Monoisotopic Mass:
221.991g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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