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31970-26-0 | 4-iodopropiophenone
CAS No: 31970-26-0 Catalog No: AG00CLP0 MDL No:MFCD09813773
Product Description
Catalog Number:
AG00CLP0
Chemical Name:
4-iodopropiophenone
CAS Number:
31970-26-0
Molecular Formula:
C9H9IO
Molecular Weight:
260.0716
MDL Number:
MFCD09813773
IUPAC Name:
1-(4-iodophenyl)propan-1-one
InChI:
InChI=1S/C9H9IO/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6H,2H2,1H3
InChI Key:
FJTCRHXSVHRKBR-UHFFFAOYSA-N
SMILES:
CCC(=O)c1ccc(cc1)I
NSC Number:
83575
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.97g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.074g/mol
Monoisotopic Mass:
259.97g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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