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Home Halogens Methyl 3-(4-chloro-1-ethyl-1H-pyrazol-3-yl)-3-oxopropanoate

Methyl 3-(4-chloro-1-ethyl-1H-pyrazol-3-yl)-3-oxopropanoate

CAS No.:
1229623-87-3
Catalog Number:
AG01F4X7
Molecular Formula:
C9H11ClN2O3
Molecular Weight:
230.6482
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
1 week
United States
$163
- +
250mg
1 week
United States
$260
- +
1g
1 week
United States
$467
- +
Product Description
Catalog Number:
AG01F4X7
Chemical Name:
Methyl 3-(4-chloro-1-ethyl-1H-pyrazol-3-yl)-3-oxopropanoate
CAS Number:
1229623-87-3
Molecular Formula:
C9H11ClN2O3
Molecular Weight:
230.6482
MDL Number:
MFCD15143184
IUPAC Name:
methyl 3-(4-chloro-1-ethylpyrazol-3-yl)-3-oxopropanoate
InChI:
InChI=1S/C9H11ClN2O3/c1-3-12-5-6(10)9(11-12)7(13)4-8(14)15-2/h5H,3-4H2,1-2H3
InChI Key:
AMJLQPANUOPTCH-UHFFFAOYSA-N
SMILES:
COC(=O)CC(=O)c1nn(cc1Cl)CC
Properties
Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.046g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.648g/mol
Monoisotopic Mass:
230.046g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
61.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties