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32896-02-9 | 3,4-Dibromothiophene-2-carboxaldehyde
CAS No: 32896-02-9 Catalog No: AG003IFS MDL No:MFCD08281875
Product Description
Catalog Number:
AG003IFS
Chemical Name:
3,4-Dibromothiophene-2-carboxaldehyde
CAS Number:
32896-02-9
Molecular Formula:
C5H2Br2OS
Molecular Weight:
269.9418
MDL Number:
MFCD08281875
IUPAC Name:
3,4-dibromothiophene-2-carbaldehyde
InChI:
InChI=1S/C5H2Br2OS/c6-3-2-9-4(1-8)5(3)7/h1-2H
InChI Key:
QCCFUWPEUHXQMH-UHFFFAOYSA-N
SMILES:
O=Cc1scc(c1Br)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:
2.8
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