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Home Halogens methyl (Z)-(3-bromo-4-methyl-5-oxofuran-2(5H)-ylidene)ethanoate

methyl (Z)-(3-bromo-4-methyl-5-oxofuran-2(5H)-ylidene)ethanoate

CAS No.:
1451878-28-6
Catalog Number:
AG01DTLV
Molecular Formula:
C8H7BrO4
Molecular Weight:
247.0428
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$44
- +
250mg
95%
In Stock USA
United States
$82
- +
1g
95%
In Stock USA
United States
$164
- +
5g
95%
In Stock USA
United States
$492
- +
Product Description
Catalog Number:
AG01DTLV
Chemical Name:
methyl (Z)-(3-bromo-4-methyl-5-oxofuran-2(5H)-ylidene)ethanoate
CAS Number:
1451878-28-6
Molecular Formula:
C8H7BrO4
Molecular Weight:
247.0428
MDL Number:
MFCD31801914
IUPAC Name:
methyl 2-(3-bromo-4-methyl-5-oxofuran-2-ylidene)acetate
InChI:
InChI=1S/C8H7BrO4/c1-4-7(9)5(13-8(4)11)3-6(10)12-2/h3H,1-2H3
InChI Key:
GOKPGZYFWLVXRH-UHFFFAOYSA-N
SMILES:
COC(=O)/C=C/1\OC(=O)C(=C1Br)C
Properties
Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.953g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.044g/mol
Monoisotopic Mass:
245.953g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.1  
Properties