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14425-64-0 | Benzene, 1-(2-bromoethyl)-4-methoxy-
CAS No: 14425-64-0 Catalog No: AG001J6F MDL No:MFCD07369786
Product Description
Catalog Number:
AG001J6F
Chemical Name:
Benzene, 1-(2-bromoethyl)-4-methoxy-
CAS Number:
14425-64-0
Molecular Formula:
C9H11BrO
Molecular Weight:
215.0870
MDL Number:
MFCD07369786
IUPAC Name:
1-(2-bromoethyl)-4-methoxybenzene
InChI:
InChI=1S/C9H11BrO/c1-11-9-4-2-8(3-5-9)6-7-10/h2-5H,6-7H2,1H3
InChI Key:
OXHPTABOQVHKLN-UHFFFAOYSA-N
SMILES:
BrCCc1ccc(cc1)OC
EC Number:
238-393-8
NSC Number:
211474
Properties
Complexity:
97.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.999g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.09g/mol
Monoisotopic Mass:
213.999g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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