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125797-09-3 | Benzene, 1-(2-bromoethoxy)-3-ethyl-
CAS No: 125797-09-3 Catalog No: AG000OQZ MDL No:MFCD06654959
Product Description
Catalog Number:
AG000OQZ
Chemical Name:
Benzene, 1-(2-bromoethoxy)-3-ethyl-
CAS Number:
125797-09-3
Molecular Formula:
C10H13BrO
Molecular Weight:
229.1136
MDL Number:
MFCD06654959
IUPAC Name:
1-(2-bromoethoxy)-3-ethylbenzene
InChI:
InChI=1S/C10H13BrO/c1-2-9-4-3-5-10(8-9)12-7-6-11/h3-5,8H,2,6-7H2,1H3
InChI Key:
MMUVKYKAWRDETJ-UHFFFAOYSA-N
SMILES:
BrCCOc1cccc(c1)CC
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.015g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.117g/mol
Monoisotopic Mass:
228.015g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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