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253429-30-0 | 1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
CAS No: 253429-30-0 Catalog No: AG00BFJL MDL No:MFCD13191631
Product Description
Catalog Number:
AG00BFJL
Chemical Name:
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
CAS Number:
253429-30-0
Molecular Formula:
C12H16BrFO3
Molecular Weight:
307.1560
MDL Number:
MFCD13191631
IUPAC Name:
1-bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
InChI:
InChI=1S/C12H16BrFO3/c1-3-15-12(16-4-2)8-17-11-7-9(14)5-6-10(11)13/h5-7,12H,3-4,8H2,1-2H3
InChI Key:
ULSLPPOVDLNXSG-UHFFFAOYSA-N
SMILES:
CCOC(COc1cc(F)ccc1Br)OCC
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.027g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
307.159g/mol
Monoisotopic Mass:
306.027g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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