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1596-42-5 | Benzene, (2-propyn-1-ylseleno)-
CAS No: 1596-42-5 Catalog No: AG001R7F MDL No:
Product Description
Catalog Number:
AG001R7F
Chemical Name:
Benzene, (2-propyn-1-ylseleno)-
CAS Number:
1596-42-5
Molecular Formula:
C9H8Se
Molecular Weight:
195.1198
IUPAC Name:
prop-2-ynylselanylbenzene
InChI:
InChI=1S/C9H8Se/c1-2-8-10-9-6-4-3-5-7-9/h1,3-7H,8H2
InChI Key:
XDMWGGPPZZOFIA-UHFFFAOYSA-N
SMILES:
C#CC[Se]c1ccccc1
Properties
Complexity:
125
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.979g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.134g/mol
Monoisotopic Mass:
195.979g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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