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128426-47-1 | Benzene, 2-chloro-4-fluoro-1-(2-propen-1-yl)-
CAS No: 128426-47-1 Catalog No: AG000Y2Q MDL No:MFCD09801306
Product Description
Catalog Number:
AG000Y2Q
Chemical Name:
Benzene, 2-chloro-4-fluoro-1-(2-propen-1-yl)-
CAS Number:
128426-47-1
Molecular Formula:
C9H8ClF
Molecular Weight:
170.6112
MDL Number:
MFCD09801306
IUPAC Name:
2-chloro-4-fluoro-1-prop-2-enylbenzene
InChI:
InChI=1S/C9H8ClF/c1-2-3-7-4-5-8(11)6-9(7)10/h2,4-6H,1,3H2
InChI Key:
UZJWZDVCADQARQ-UHFFFAOYSA-N
SMILES:
C=CCc1ccc(cc1Cl)F
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.03g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.611g/mol
Monoisotopic Mass:
170.03g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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