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1193-69-7 | 3-Thiophenecarboxaldehyde, 2,5-dibromo-
CAS No: 1193-69-7 Catalog No: AG000IJY MDL No:MFCD03426905
Product Description
Catalog Number:
AG000IJY
Chemical Name:
3-Thiophenecarboxaldehyde, 2,5-dibromo-
CAS Number:
1193-69-7
Molecular Formula:
C5H2Br2OS
Molecular Weight:
269.9418
MDL Number:
MFCD03426905
IUPAC Name:
2,5-dibromothiophene-3-carbaldehyde
InChI:
InChI=1S/C5H2Br2OS/c6-4-1-3(2-8)5(7)9-4/h1-2H
InChI Key:
GBJBDOWMZMXKCD-UHFFFAOYSA-N
SMILES:
O=Cc1cc(sc1Br)Br
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.817g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.938g/mol
Monoisotopic Mass:
267.819g/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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