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116779-75-0 | Ethane, 1-bromo-1-ethoxy-
CAS No: 116779-75-0 Catalog No: AG000D72 MDL No:
Product Description
Catalog Number:
AG000D72
Chemical Name:
Ethane, 1-bromo-1-ethoxy-
CAS Number:
116779-75-0
Molecular Formula:
C4H9BrO
Molecular Weight:
153.0177
IUPAC Name:
1-bromo-1-ethoxyethane
InChI:
InChI=1S/C4H9BrO/c1-3-6-4(2)5/h4H,3H2,1-2H3
InChI Key:
DGWGSHNCXHQSFP-UHFFFAOYSA-N
SMILES:
CCOC(Br)C
Properties
Complexity:
30.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.984g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.019g/mol
Monoisotopic Mass:
151.984g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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