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(3-Bromo-2-thienyl)-2-thienylmethanone

HCID 901437
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Basic information

CAS
353269-00-8
Standard SMILES
O=C(c1cccs1)c1sccc1Br
InChIKey
LJMYENPUGXCCNQ-UHFFFAOYSA-N
Molecular formula
C9H5BrOS2
Average molar mass
273.2 g/mol
Monoisotopic mass
271.89652

Names & identifiers

Preferred name
(3-Bromo-2-thienyl)-2-thienylmethanone
IUPAC
(3-bromothiophen-2-yl)-thiophen-2-ylmethanone

Names & synonyms

(3-Bromo-2-thienyl)-2-thienylmethanoneDTXSID001284479AKOS013108771353269-00-8(3-Bromothiophen-2-yl)(thiophen-2-yl)methanone

Database identifiers

CAS
353269-00-8
PubChem CID
901437
DTXSID
DTXSID001284479

Properties

Computed structural properties

XLogP
4
Topological polar surface area
73.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
13
Formal charge
0
Complexity
210

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Compound notes

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