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1224720-05-1

1224720-05-1 | Benzenemethanol, 3-bromo-4-ethoxy-

CAS No: 1224720-05-1 Catalog No: AG00179V MDL No:MFCD17292281

Product Description

Catalog Number:
AG00179V
Chemical Name:
Benzenemethanol, 3-bromo-4-ethoxy-
CAS Number:
1224720-05-1
Molecular Formula:
C9H11BrO2
Molecular Weight:
231.0864
MDL Number:
MFCD17292281
IUPAC Name:
(3-bromo-4-ethoxyphenyl)methanol
InChI:
InChI=1S/C9H11BrO2/c1-2-12-9-4-3-7(6-11)5-8(9)10/h3-5,11H,2,6H2,1H3
InChI Key:
QJCLEQVUWMMZLU-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1Br)CO

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:
2.1  

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