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114046-35-4 | Acetic acid, 2-[[(1-methylethylidene)amino]oxy]-, 2-methoxy-2-oxoethyl ester
CAS No: 114046-35-4 Catalog No: AG000AF0 MDL No:
Product Description
Catalog Number:
AG000AF0
Chemical Name:
Acetic acid, 2-[[(1-methylethylidene)amino]oxy]-, 2-methoxy-2-oxoethyl ester
CAS Number:
114046-35-4
Molecular Formula:
C8H13NO5
Molecular Weight:
203.1925
IUPAC Name:
methyl 2-[2-(propan-2-ylideneamino)oxyacetyl]oxyacetate
InChI:
InChI=1S/C8H13NO5/c1-6(2)9-14-5-8(11)13-4-7(10)12-3/h4-5H2,1-3H3
InChI Key:
XRGASIIWBGQTPN-UHFFFAOYSA-N
SMILES:
COC(=O)COC(=O)CON=C(C)C
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.194g/mol
Monoisotopic Mass:
203.079g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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