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116256-08-7 | Benzene, 2-bromo-1-(3-chloropropoxy)-4-fluoro-
CAS No: 116256-08-7 Catalog No: AG000C1Z MDL No:
Product Description
Catalog Number:
AG000C1Z
Chemical Name:
Benzene, 2-bromo-1-(3-chloropropoxy)-4-fluoro-
CAS Number:
116256-08-7
Molecular Formula:
C9H9BrClFO
Molecular Weight:
267.5226
IUPAC Name:
2-bromo-1-(3-chloropropoxy)-4-fluorobenzene
InChI:
InChI=1S/C9H9BrClFO/c10-8-6-7(12)2-3-9(8)13-5-1-4-11/h2-3,6H,1,4-5H2
InChI Key:
FXBDHOSEZLOGQL-UHFFFAOYSA-N
SMILES:
ClCCCOc1ccc(cc1Br)F
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.951g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.522g/mol
Monoisotopic Mass:
265.951g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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