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114646-89-8

114646-89-8 | Butanoic acid, 2-methylene-, (2-ethyl-2-oxiranyl)methyl ester

CAS No: 114646-89-8 Catalog No: AG000EX5 MDL No:

Product Description

Catalog Number:
AG000EX5
Chemical Name:
Butanoic acid, 2-methylene-, (2-ethyl-2-oxiranyl)methyl ester
CAS Number:
114646-89-8
Molecular Formula:
C10H16O3
Molecular Weight:
184.2322
IUPAC Name:
(2-ethyloxiran-2-yl)methyl 2-methylidenebutanoate
InChI:
InChI=1S/C10H16O3/c1-4-8(3)9(11)12-6-10(5-2)7-13-10/h3-7H2,1-2H3
InChI Key:
XOIOOCRFRWUXNR-UHFFFAOYSA-N
SMILES:
CCC(=C)C(=O)OCC1(CC)OC1

Properties

Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.11g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.235g/mol
Monoisotopic Mass:
184.11g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

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