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175277-95-9

175277-95-9 | Benzene, 1-ethyl-2-iodo-3-methyl-

CAS No: 175277-95-9 Catalog No: AG0020U0 MDL No:MFCD00052855

Product Description

Catalog Number:
AG0020U0
Chemical Name:
Benzene, 1-ethyl-2-iodo-3-methyl-
CAS Number:
175277-95-9
Molecular Formula:
C9H11I
Molecular Weight:
246.0881
MDL Number:
MFCD00052855
IUPAC Name:
1-ethyl-2-iodo-3-methylbenzene
InChI:
InChI=1S/C9H11I/c1-3-8-6-4-5-7(2)9(8)10/h4-6H,3H2,1-2H3
InChI Key:
PCSPENCTMKMGFE-UHFFFAOYSA-N
SMILES:
CCc1cccc(c1I)C

Properties

Complexity:
101  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.991g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.091g/mol
Monoisotopic Mass:
245.991g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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