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Chemical Product CAS:6684-59-9Hydrazinecarboxamide,2-(4-methylspiro[2.5]oct-4-en-8-ylidene)-

CAS:6684-59-9
Hydrazinecarboxamide,2-(4-methylspiro[2.5]oct-4-en-8-ylidene)-

  • CAS No:

    6684-59-9
  • Name:

    Hydrazinecarboxamide,2-(4-methylspiro[2.5]oct-4-en-8-ylidene)-
  • Molecular Formula:

    C10H15 N3 O
  • Molecular Weight:

    193.2456
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Hydrazinecarboxamide,2-(4-methylspiro[2.5]oct ( CASNO:6684-59-9 )

Identification and Related Records
Name:
Hydrazinecarboxamide,2-(4-methylspiro[2.5]oct-4-en-8-ylidene)-
CAS Registry number:
6684-59-9
Iupac name:
[(Z)-(4-methylspiro[2.5]oct-4-en-8-ylidene)amino]urea
Synonyms:
Spiro[2.5]oct-7-en-4-one,8-methyl-, semicarbazone (7CI,8CI)
NSC 171525
Molecular Formula:
C10H15 N3 O
Molecular Weight:
193.2456
Inchi:
InChI=1/C10H15N3O/c1-7-3-2-4-8(10(7)5-6-10)12-13-9(11)14/h3H,2,4-6H2,1H3,(H3,11,13,14)/b12-8-
Canonical SMILES:
CC1=CCCC(=NNC(=O)N)C12CC2
Isomers smiles:
CC1=CCC/C(=N/NC(=O)N)/C12CC2
Chemical and Physical Properties
Density:
1.33g/cm3
Refractive Index:
1.65
Computed Properties:
Molecular Weight:193.2456 [g/mol]
Molecular Formula:C10H15N3O
XLogP3-AA:0.2
H-Bond Donor:2
H-Bond Acceptor:2
Rotatable Bond Count:1
Tautomer Count:3
Exact Mass:193.121512
MonoIsotopic Mass:193.121512
Topological Polar Surface Area:67.5
Heavy Atom Count:14
Formal Charge:0
Complexity:326
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:1
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:2
Feature 3D Donor Count:2
Feature 3D Ring Count:1
Effective Rotor Count:2.8
Conformer Sampling RMSD:0.6
CID Conformer Count:3
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