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18168-59-7 | 3-Selenophenecarboxaldehyde
CAS No: 18168-59-7 Catalog No: AG00231M MDL No:
Product Description
Catalog Number:
AG00231M
Chemical Name:
3-Selenophenecarboxaldehyde
CAS Number:
18168-59-7
Molecular Formula:
C5H4OSe
Molecular Weight:
159.0447
IUPAC Name:
selenophene-3-carbaldehyde
InChI:
InChI=1S/C5H4OSe/c6-3-5-1-2-7-4-5/h1-4H
InChI Key:
IPWXJCOSPVHJLK-UHFFFAOYSA-N
SMILES:
O=Cc1c[se]cc1
Properties
Complexity:
72.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.943g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
159.057g/mol
Monoisotopic Mass:
159.943g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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