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247569-90-0 | Benzene, 4-(bromomethyl)-1-chloro-2-ethoxy-
CAS No: 247569-90-0 Catalog No: AG002PBV MDL No:
Product Description
Catalog Number:
AG002PBV
Chemical Name:
Benzene, 4-(bromomethyl)-1-chloro-2-ethoxy-
CAS Number:
247569-90-0
Molecular Formula:
C9H10BrClO
Molecular Weight:
249.5321
IUPAC Name:
4-(bromomethyl)-1-chloro-2-ethoxybenzene
InChI:
InChI=1S/C9H10BrClO/c1-2-12-9-5-7(6-10)3-4-8(9)11/h3-5H,2,6H2,1H3
InChI Key:
YFVHKXBOEACTME-UHFFFAOYSA-N
SMILES:
CCOc1cc(CBr)ccc1Cl
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.96g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.532g/mol
Monoisotopic Mass:
247.96g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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