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919290-12-3 | Propanedioic acid, 2-(2-oxazolidinylidene)-, 1,3-dimethyl ester
CAS No: 919290-12-3 Catalog No: AG006JX0 MDL No:
Product Description
Catalog Number:
AG006JX0
Chemical Name:
Propanedioic acid, 2-(2-oxazolidinylidene)-, 1,3-dimethyl ester
CAS Number:
919290-12-3
Molecular Formula:
C8H11NO5
Molecular Weight:
201.1766
IUPAC Name:
dimethyl 2-(1,3-oxazolidin-2-ylidene)propanedioate
InChI:
InChI=1S/C8H11NO5/c1-12-7(10)5(8(11)13-2)6-9-3-4-14-6/h9H,3-4H2,1-2H3
InChI Key:
NQAUUWBDALDZKN-UHFFFAOYSA-N
SMILES:
COC(=O)C(=C1NCCO1)C(=O)OC
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.064g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.178g/mol
Monoisotopic Mass:
201.064g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
73.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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