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Home > Aldehydes > 1014644-76-8
1014644-76-8 | 3-Thiophenecarboxaldehyde, 2-bromo-5-chloro-
CAS No: 1014644-76-8 Catalog No: AG0004JE MDL No:
Product Description
Catalog Number:
AG0004JE
Chemical Name:
3-Thiophenecarboxaldehyde, 2-bromo-5-chloro-
CAS Number:
1014644-76-8
Molecular Formula:
C5H2BrClOS
Molecular Weight:
225.4908
IUPAC Name:
2-bromo-5-chlorothiophene-3-carbaldehyde
InChI:
InChI=1S/C5H2BrClOS/c6-5-3(2-8)1-4(7)9-5/h1-2H
InChI Key:
MZQPJXYLOGFQIZ-UHFFFAOYSA-N
SMILES:
O=Cc1cc(sc1Br)Cl
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.87g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.484g/mol
Monoisotopic Mass:
223.87g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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