Home Halogens methyl 2-chloro-2-methylpropanoate

methyl 2-chloro-2-methylpropanoate

CAS No.:
22421-97-2
Catalog Number:
AG01BCVN
Molecular Formula:
C5H9ClO2
Molecular Weight:
136.5768
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Product Description
Catalog Number:
AG01BCVN
Chemical Name:
methyl 2-chloro-2-methylpropanoate
CAS Number:
22421-97-2
Molecular Formula:
C5H9ClO2
Molecular Weight:
136.5768
MDL Number:
MFCD01697507
IUPAC Name:
methyl 2-chloro-2-methylpropanoate
InChI:
InChI=1S/C5H9ClO2/c1-5(2,6)4(7)8-3/h1-3H3
InChI Key:
GJWBUVKJZQLZNB-UHFFFAOYSA-N
SMILES:
COC(=O)C(Cl)(C)C
Properties
Complexity:
98.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.029g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.575g/mol
Monoisotopic Mass:
136.029g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties