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23399-77-1 | Benzene, 4-chloro-1-iodo-2-(trifluoromethyl)-
CAS No: 23399-77-1 Catalog No: AG002N2V MDL No:MFCD00042579
Product Description
Catalog Number:
AG002N2V
Chemical Name:
Benzene, 4-chloro-1-iodo-2-(trifluoromethyl)-
CAS Number:
23399-77-1
Molecular Formula:
C7H3ClF3I
Molecular Weight:
306.4514
MDL Number:
MFCD00042579
IUPAC Name:
4-chloro-1-iodo-2-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H3ClF3I/c8-4-1-2-6(12)5(3-4)7(9,10)11/h1-3H
InChI Key:
DRMQJFVDZWIKTE-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)C(F)(F)F)I
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.892g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.451g/mol
Monoisotopic Mass:
305.892g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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