Home Halogens methyl 4-chloro-2-methylbut-2-enoate

methyl 4-chloro-2-methylbut-2-enoate

CAS No.:
56905-07-8
Catalog Number:
AG019SCF
Molecular Formula:
C6H9ClO2
Molecular Weight:
148.5875
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Product Description
Catalog Number:
AG019SCF
Chemical Name:
methyl 4-chloro-2-methylbut-2-enoate
CAS Number:
56905-07-8
Molecular Formula:
C6H9ClO2
Molecular Weight:
148.5875
IUPAC Name:
methyl 4-chloro-2-methylbut-2-enoate
InChI:
InChI=1S/C6H9ClO2/c1-5(3-4-7)6(8)9-2/h3H,4H2,1-2H3
InChI Key:
LTZAWBBRKABPAL-UHFFFAOYSA-N
SMILES:
CC(=CCCl)C(=O)OC
Properties
Complexity:
129  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.029g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.586g/mol
Monoisotopic Mass:
148.029g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.3  
Properties