Home Carboxys methyl 3-(2-methoxyphenyl)-3-methyloxirane-2-carboxylate, Mixture of diastereomers

methyl 3-(2-methoxyphenyl)-3-methyloxirane-2-carboxylate, Mixture of diastereomers

CAS No.:
1482580-51-7
Catalog Number:
AG01EK2L
Molecular Formula:
C12H14O4
Molecular Weight:
222.2372
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Product Description
Catalog Number:
AG01EK2L
Chemical Name:
methyl 3-(2-methoxyphenyl)-3-methyloxirane-2-carboxylate, Mixture of diastereomers
CAS Number:
1482580-51-7
Molecular Formula:
C12H14O4
Molecular Weight:
222.2372
MDL Number:
MFCD21321554
IUPAC Name:
methyl 3-(2-methoxyphenyl)-3-methyloxirane-2-carboxylate
InChI:
InChI=1S/C12H14O4/c1-12(10(16-12)11(13)15-3)8-6-4-5-7-9(8)14-2/h4-7,10H,1-3H3
InChI Key:
VLYREJMJQZGCTP-UHFFFAOYSA-N
SMILES:
COC(=O)C1OC1(C)c1ccccc1OC
Properties
Complexity:
278  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.089g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.24g/mol
Monoisotopic Mass:
222.089g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties