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851314-92-6 | Benzene, 2-(2-chloro-1,1-dimethylethyl)-4-fluoro-1-methoxy-
CAS No: 851314-92-6 Catalog No: AG004O3X MDL No:
Product Description
Catalog Number:
AG004O3X
Chemical Name:
Benzene, 2-(2-chloro-1,1-dimethylethyl)-4-fluoro-1-methoxy-
CAS Number:
851314-92-6
Molecular Formula:
C11H14ClFO
Molecular Weight:
216.6797
IUPAC Name:
2-(1-chloro-2-methylpropan-2-yl)-4-fluoro-1-methoxybenzene
InChI:
InChI=1S/C11H14ClFO/c1-11(2,7-12)9-6-8(13)4-5-10(9)14-3/h4-6H,7H2,1-3H3
InChI Key:
IKDBKNBCXCCQCG-UHFFFAOYSA-N
SMILES:
ClCC(c1cc(F)ccc1OC)(C)C
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.072g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.68g/mol
Monoisotopic Mass:
216.072g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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