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1065478-58-1 | (E)-ethyl 3-(5-methylisoxazol-3-yl)acrylate
CAS No: 1065478-58-1 Catalog No: AG01DJ50 MDL No:MFCD22412790
Product Description
Catalog Number:
AG01DJ50
Chemical Name:
(E)-ethyl 3-(5-methylisoxazol-3-yl)acrylate
CAS Number:
1065478-58-1
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
MDL Number:
MFCD22412790
IUPAC Name:
ethyl (E)-3-(5-methyl-1,2-oxazol-3-yl)prop-2-enoate
InChI:
InChI=1S/C9H11NO3/c1-3-12-9(11)5-4-8-6-7(2)13-10-8/h4-6H,3H2,1-2H3/b5-4+
InChI Key:
NEUIHVIMBYUVCG-SNAWJCMRSA-N
SMILES:
CCOC(=O)/C=C/c1noc(c1)C
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
181.074g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.191g/mol
Monoisotopic Mass:
181.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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