Home Halogens methyl 5-(1-chloroethyl)-3-methylfuran-2-carboxylate

methyl 5-(1-chloroethyl)-3-methylfuran-2-carboxylate

CAS No.:
1421601-77-5
Catalog Number:
AG01A11D
Molecular Formula:
C9H11ClO3
Molecular Weight:
202.6348
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Product Description
Catalog Number:
AG01A11D
Chemical Name:
methyl 5-(1-chloroethyl)-3-methylfuran-2-carboxylate
CAS Number:
1421601-77-5
Molecular Formula:
C9H11ClO3
Molecular Weight:
202.6348
MDL Number:
MFCD22392126
IUPAC Name:
methyl 5-(1-chloroethyl)-3-methylfuran-2-carboxylate
InChI:
InChI=1S/C9H11ClO3/c1-5-4-7(6(2)10)13-8(5)9(11)12-3/h4,6H,1-3H3
InChI Key:
LSDNHZRRFUVZKR-UHFFFAOYSA-N
SMILES:
COC(=O)c1oc(cc1C)C(Cl)C
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.04g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.634g/mol
Monoisotopic Mass:
202.04g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties