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766-50-7

766-50-7 | 1-ETHYNYL-2-IODO-BENZENE

CAS No: 766-50-7 Catalog No: AG005AOW MDL No:MFCD08703580

Product Description

Catalog Number:
AG005AOW
Chemical Name:
1-ETHYNYL-2-IODO-BENZENE
CAS Number:
766-50-7
Molecular Formula:
C8H5I
Molecular Weight:
228.0298
MDL Number:
MFCD08703580
IUPAC Name:
1-ethynyl-2-iodobenzene
InChI:
InChI=1S/C8H5I/c1-2-7-5-3-4-6-8(7)9/h1,3-6H
InChI Key:
TZZCAXOOMCXIPJ-UHFFFAOYSA-N
SMILES:
C#Cc1ccccc1I

Properties

Complexity:
131  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.944g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.032g/mol
Monoisotopic Mass:
227.944g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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