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1260761-52-1 | Benzene, 2-(2-bromoethyl)-1,3-difluoro-5-methoxy-
CAS No: 1260761-52-1 Catalog No: AG000R5D MDL No:
Product Description
Catalog Number:
AG000R5D
Chemical Name:
Benzene, 2-(2-bromoethyl)-1,3-difluoro-5-methoxy-
CAS Number:
1260761-52-1
Molecular Formula:
C9H9BrF2O
Molecular Weight:
251.0680
IUPAC Name:
2-(2-bromoethyl)-1,3-difluoro-5-methoxybenzene
InChI:
InChI=1S/C9H9BrF2O/c1-13-6-4-8(11)7(2-3-10)9(12)5-6/h4-5H,2-3H2,1H3
InChI Key:
RDVSGZMMTMRQIL-UHFFFAOYSA-N
SMILES:
BrCCc1c(F)cc(cc1F)OC
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.98g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.071g/mol
Monoisotopic Mass:
249.98g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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