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16742-18-0 | Phenoxyacetaldehyde semicarbazone
CAS No: 16742-18-0 Catalog No: AG00B5KK MDL No:
Product Description
Catalog Number:
AG00B5KK
Chemical Name:
Phenoxyacetaldehyde semicarbazone
CAS Number:
16742-18-0
IUPAC Name:
[(Z)-2-phenoxyethylideneamino]urea
InChI:
InChI=1S/C9H11N3O2/c10-9(13)12-11-6-7-14-8-4-2-1-3-5-8/h1-6H,7H2,(H3,10,12,13)/b11-6-
InChI Key:
NANMXUXUOHSFNU-WDZFZDKYSA-N
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
193.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
193.206g/mol
Monoisotopic Mass:
193.085g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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