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1260777-24-9 | Benzene, 2-(2-chloroethyl)-4-fluoro-1-methyl-
CAS No: 1260777-24-9 Catalog No: AG000R73 MDL No:
Product Description
Catalog Number:
AG000R73
Chemical Name:
Benzene, 2-(2-chloroethyl)-4-fluoro-1-methyl-
CAS Number:
1260777-24-9
Molecular Formula:
C9H10ClF
Molecular Weight:
172.6271
IUPAC Name:
2-(2-chloroethyl)-4-fluoro-1-methylbenzene
InChI:
InChI=1S/C9H10ClF/c1-7-2-3-9(11)6-8(7)4-5-10/h2-3,6H,4-5H2,1H3
InChI Key:
LJWPQKQCRSIFPS-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1CCCl)F
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.046g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.627g/mol
Monoisotopic Mass:
172.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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