Home Halogens Methyl 3-bromopropiolate

Methyl 3-bromopropiolate

CAS No.:
23680-40-2
Catalog Number:
AG002O5H
Molecular Formula:
C4H3BrO2
Molecular Weight:
162.9694
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
In Stock USA
United States
$75
- +
1g
97%
In Stock USA
United States
$188
- +
5g
97%
In Stock USA
United States
$532
- +
10g
97%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG002O5H
Chemical Name:
Methyl 3-bromopropiolate
CAS Number:
23680-40-2
Molecular Formula:
C4H3BrO2
Molecular Weight:
162.9694
MDL Number:
MFCD22989330
IUPAC Name:
methyl 3-bromoprop-2-ynoate
InChI:
InChI=1S/C4H3BrO2/c1-7-4(6)2-3-5/h1H3
InChI Key:
PITMUHRRCBFULF-UHFFFAOYSA-N
SMILES:
COC(=O)C#CBr
NSC Number:
163453
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.932g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.97g/mol
Monoisotopic Mass:
161.932g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
Synthesis of 1-methyl-3-oxo-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid methyl ester. Molecules (Basel, Switzerland) 20051130
Properties