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18287-04-2 | 2-Butene, 4-bromo-1,1-dimethoxy-, (2E)-
CAS No: 18287-04-2 Catalog No: AG00247O MDL No:
Product Description
Catalog Number:
AG00247O
Chemical Name:
2-Butene, 4-bromo-1,1-dimethoxy-, (2E)-
CAS Number:
18287-04-2
Molecular Formula:
C6H11BrO2
Molecular Weight:
195.0543
IUPAC Name:
4-bromo-1,1-dimethoxybut-2-ene
InChI:
InChI=1S/C6H11BrO2/c1-8-6(9-2)4-3-5-7/h3-4,6H,5H2,1-2H3
InChI Key:
MOZFVZIBEWQCQW-UHFFFAOYSA-N
SMILES:
BrC/C=C/C(OC)OC
Properties
Complexity:
79.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.994g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.056g/mol
Monoisotopic Mass:
193.994g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.1
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