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24827-27-8 | Carbonic acid, ethyl 3-isoxazolyl ester
CAS No: 24827-27-8 Catalog No: AG002PKU MDL No:
Product Description
Catalog Number:
AG002PKU
Chemical Name:
Carbonic acid, ethyl 3-isoxazolyl ester
CAS Number:
24827-27-8
IUPAC Name:
ethyl 1,2-oxazol-3-yl carbonate
InChI:
InChI=1S/C6H7NO4/c1-2-9-6(8)11-5-3-4-10-7-5/h3-4H,2H2,1H3
InChI Key:
MPGDJQRWDSFDTF-UHFFFAOYSA-N
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.038g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.125g/mol
Monoisotopic Mass:
157.038g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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