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87728-82-3 | Thiophene, 2-[2-(phenylseleno)-2-propenyl]-
CAS No: 87728-82-3 Catalog No: AG004GB2 MDL No:
Product Description
Catalog Number:
AG004GB2
Chemical Name:
Thiophene, 2-[2-(phenylseleno)-2-propenyl]-
CAS Number:
87728-82-3
Molecular Formula:
C13H12SSe
Molecular Weight:
279.2594
IUPAC Name:
2-(2-phenylselanylprop-2-enyl)thiophene
InChI:
InChI=1S/C13H12SSe/c1-11(10-12-6-5-9-14-12)15-13-7-3-2-4-8-13/h2-9H,1,10H2
InChI Key:
JTDMXAPLIFBSFF-UHFFFAOYSA-N
SMILES:
C=C(Cc1cccs1)[Se]c1ccccc1
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.982g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.27g/mol
Monoisotopic Mass:
279.982g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
28.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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