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294864-24-7 | Ethanol, 2-bromo-1-ethoxy-
CAS No: 294864-24-7 Catalog No: AG002YK0 MDL No:
Product Description
Catalog Number:
AG002YK0
Chemical Name:
Ethanol, 2-bromo-1-ethoxy-
CAS Number:
294864-24-7
Molecular Formula:
C4H9BrO2
Molecular Weight:
169.0171
IUPAC Name:
2-bromo-1-ethoxyethanol
InChI:
InChI=1S/C4H9BrO2/c1-2-7-4(6)3-5/h4,6H,2-3H2,1H3
InChI Key:
RLSMARKFQHRDIP-UHFFFAOYSA-N
SMILES:
CCOC(CBr)O
Properties
Complexity:
40.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.979g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
169.018g/mol
Monoisotopic Mass:
167.979g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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