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1601187-55-6 | 5-(4-bromothiophen-3-yl)pyridine-3-carbaldehyde
CAS No: 1601187-55-6 Catalog No: AG01C7LI MDL No:MFCD31438780
Product Description
Catalog Number:
AG01C7LI
Chemical Name:
5-(4-bromothiophen-3-yl)pyridine-3-carbaldehyde
CAS Number:
1601187-55-6
Molecular Formula:
C10H6BrNOS
Molecular Weight:
268.1297
MDL Number:
MFCD31438780
IUPAC Name:
5-(4-bromothiophen-3-yl)pyridine-3-carbaldehyde
InChI:
InChI=1S/C10H6BrNOS/c11-10-6-14-5-9(10)8-1-7(4-13)2-12-3-8/h1-6H
InChI Key:
MRFKOMAMDRRIEU-UHFFFAOYSA-N
SMILES:
O=Cc1cncc(c1)c1cscc1Br
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.935g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.128g/mol
Monoisotopic Mass:
266.935g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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