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844691-83-4 | Benzene, 1-[(3-methoxy-1-propynyl)seleno]-4-methyl-
CAS No: 844691-83-4 Catalog No: AG004W1W MDL No:
Product Description
Catalog Number:
AG004W1W
Chemical Name:
Benzene, 1-[(3-methoxy-1-propynyl)seleno]-4-methyl-
CAS Number:
844691-83-4
Molecular Formula:
C11H12OSe
Molecular Weight:
239.1724
IUPAC Name:
1-(3-methoxyprop-1-ynylselanyl)-4-methylbenzene
InChI:
InChI=1S/C11H12OSe/c1-10-4-6-11(7-5-10)13-9-3-8-12-2/h4-7H,8H2,1-2H3
InChI Key:
ORLWUGLTEVYZQF-UHFFFAOYSA-N
SMILES:
COCC#C[Se]c1ccc(cc1)C
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.005g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.187g/mol
Monoisotopic Mass:
240.005g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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