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59577-32-1 | 2-(4-Methoxybenzyloxycarbonyloxyimino)-2-phenylacetonitrile
CAS No: 59577-32-1 Catalog No: AG003EWN MDL No:
Product Description
Catalog Number:
AG003EWN
Chemical Name:
2-(4-Methoxybenzyloxycarbonyloxyimino)-2-phenylacetonitrile
CAS Number:
59577-32-1
IUPAC Name:
[[cyano(phenyl)methylidene]amino] (4-methoxyphenyl)methyl carbonate
InChI:
InChI=1S/C17H14N2O4/c1-21-15-9-7-13(8-10-15)12-22-17(20)23-19-16(11-18)14-5-3-2-4-6-14/h2-10H,12H2,1H3
InChI Key:
IPRBOQUKBZNCAG-UHFFFAOYSA-N
Properties
Complexity:
455
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.095g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.309g/mol
Monoisotopic Mass:
310.095g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.8
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