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113996-88-6 | Propanal, 2,3-dibromo-, O-methyloxime
CAS No: 113996-88-6 Catalog No: AG000A9E MDL No:
Product Description
Catalog Number:
AG000A9E
Chemical Name:
Propanal, 2,3-dibromo-, O-methyloxime
CAS Number:
113996-88-6
Molecular Formula:
C4H7Br2NO
Molecular Weight:
244.9125
IUPAC Name:
2,3-dibromo-N-methoxyprop-2-en-1-imine
InChI:
InChI=1S/C4H5Br2NO/c1-8-7-3-4(6)2-5/h2-3H,1H3
InChI Key:
FHPLNODXHFFOJT-UHFFFAOYSA-N
SMILES:
CON=CC(CBr)Br
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.872g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.898g/mol
Monoisotopic Mass:
240.874g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
2.1
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