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137160-76-0 | 2-Propanone, O-[(phenylmethoxy)carbonyl]oxime (9CI)
CAS No: 137160-76-0 Catalog No: AG0012VF MDL No:
Product Description
Catalog Number:
AG0012VF
Chemical Name:
2-Propanone, O-[(phenylmethoxy)carbonyl]oxime (9CI)
CAS Number:
137160-76-0
Molecular Formula:
C11H13NO3
Molecular Weight:
207.2258
IUPAC Name:
benzyl (propan-2-ylideneamino) carbonate
InChI:
InChI=1S/C11H13NO3/c1-9(2)12-15-11(13)14-8-10-6-4-3-5-7-10/h3-7H,8H2,1-2H3
InChI Key:
YAECLTQWHQOIQR-UHFFFAOYSA-N
SMILES:
O=C(ON=C(C)C)OCc1ccccc1
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.229g/mol
Monoisotopic Mass:
207.09g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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