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149489-18-9 | Benzenemethanol, 5-bromo-2-ethoxy-
CAS No: 149489-18-9 Catalog No: AG001LQP MDL No:MFCD06202636
Product Description
Catalog Number:
AG001LQP
Chemical Name:
Benzenemethanol, 5-bromo-2-ethoxy-
CAS Number:
149489-18-9
Molecular Formula:
C9H11BrO2
Molecular Weight:
231.0864
MDL Number:
MFCD06202636
IUPAC Name:
(5-bromo-2-ethoxyphenyl)methanol
InChI:
InChI=1S/C9H11BrO2/c1-2-12-9-4-3-8(10)5-7(9)6-11/h3-5,11H,2,6H2,1H3
InChI Key:
RXDFHFNUPUWTRV-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1CO)Br
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.994g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.089g/mol
Monoisotopic Mass:
229.994g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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