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1369834-22-9 | 1-ethyl-4-iodo-2-methylbenzene
CAS No: 1369834-22-9 Catalog No: AG01C921 MDL No:MFCD22492385
Product Description
Catalog Number:
AG01C921
Chemical Name:
1-ethyl-4-iodo-2-methylbenzene
CAS Number:
1369834-22-9
Molecular Formula:
C9H11I
Molecular Weight:
246.0881
MDL Number:
MFCD22492385
IUPAC Name:
1-ethyl-4-iodo-2-methylbenzene
InChI:
InChI=1S/C9H11I/c1-3-8-4-5-9(10)6-7(8)2/h4-6H,3H2,1-2H3
InChI Key:
FESVPXRZWVZHMB-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1C)I
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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