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Home > Aldehydes > 161726-69-8
161726-69-8 | [2,2':5',2''-Terthiophene]-5-carboxaldehyde, 5''-bromo-
CAS No: 161726-69-8 Catalog No: AG001VUO MDL No:MFCD02093442
Product Description
Catalog Number:
AG001VUO
Chemical Name:
[2,2':5',2''-Terthiophene]-5-carboxaldehyde, 5''-bromo-
CAS Number:
161726-69-8
Molecular Formula:
C13H7BrOS3
Molecular Weight:
355.2931
MDL Number:
MFCD02093442
IUPAC Name:
5-[5-(5-bromothiophen-2-yl)thiophen-2-yl]thiophene-2-carbaldehyde
InChI:
InChI=1S/C13H7BrOS3/c14-13-6-5-12(18-13)11-4-3-10(17-11)9-2-1-8(7-15)16-9/h1-7H
InChI Key:
DSYKMLTVEGWLFR-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(s1)c1ccc(s1)c1ccc(s1)Br
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.884g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
355.282g/mol
Monoisotopic Mass:
353.884g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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