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2870-37-3 | Benzoselenazolium, 3-ethyl-2-methyl-, iodide (1:1)
CAS No: 2870-37-3 Catalog No: AG002W6R MDL No:
Product Description
Catalog Number:
AG002W6R
Chemical Name:
Benzoselenazolium, 3-ethyl-2-methyl-, iodide (1:1)
CAS Number:
2870-37-3
Molecular Formula:
C10H12INSe
Molecular Weight:
352.0734
IUPAC Name:
3-ethyl-2-methyl-1,3-benzoselenazol-3-ium;iodide
InChI:
InChI=1S/C10H12NSe.HI/c1-3-11-8(2)12-10-7-5-4-6-9(10)11;/h4-7H,3H2,1-2H3;1H/q+1;/p-1
InChI Key:
AQCQFSLQFLTOOX-UHFFFAOYSA-M
SMILES:
CC[n+]1c(C)[se]c2c1cccc2.[I-]
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.918g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.088g/mol
Monoisotopic Mass:
352.918g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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