AI56026
7575-74-8 | 4'-Chloroacetophenone semicarbazone
Manufacturer: A2B Chem
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CatalogNumber
AI56026
ChemicalName
4'-Chloroacetophenone semicarbazone
CasNumber
7575-74-8
MolecularFormula
C9H10ClN3O
MolecularWeight
211.6482
MdlNumber
MFCD01568803
Smiles
C/C(=N\NC(=O)N)/c1ccc(cc1)Cl
Complexity
234
Covalently-bondedUnitCount
1
DefinedBondStereocenterCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
1.4
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CatalogNumber: AI56026
ChemicalName: 4'-Chloroacetophenone semicarbazone
CasNumber: 7575-74-8
MolecularFormula: C9H10ClN3O
MolecularWeight: 211.6482
MdlNumber: MFCD01568803
Smiles: C/C(=N\NC(=O)N)/c1ccc(cc1)Cl
Complexity: 234
Covalently-bondedUnitCount: 1
DefinedBondStereocenterCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 1.4
CatalogNumber:
AI56026
ChemicalName:
4'-Chloroacetophenone semicarbazone
CasNumber:
7575-74-8
MolecularFormula:
C9H10ClN3O
MolecularWeight:
211.6482
MdlNumber:
MFCD01568803
Smiles:
C/C(=N\NC(=O)N)/c1ccc(cc1)Cl
Complexity:
234
Covalently-bondedUnitCount:
1
DefinedBondStereocenterCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
1.4
CatalogNumber: AI56027
ChemicalName: Tris[4,4'-di-tert-butyl-(2,2')-bipyridine]ruthenium(II) dihexafluorophosphate
CasNumber: 75777-87-6
MolecularFormula: C54H72F12N6P2Ru
MolecularWeight: 1196.1880404000008
MdlNumber: MFCD12022556
Smiles: [F-][P+5]([F-])([F-])([F-])([F-])[F-].[F-][P+5]([F-])([F-])([F-])([F-])[F-].CC(C1=CC=[N]2C(=C1)C1=[N]([Ru+2]342([N]2=CC=C(C=C2C2=[N]4C=CC(=C2)C(C)(C)C)C(C)(C)C)[N]2=CC=C(C=C2C2=[N]3C=CC(=C2)C(C)(C)C)C(C)(C)C)C=CC(=C1)C(C)(C)C)(C)C
Complexity: 341
Covalently-bondedUnitCount: 6
DefinedBondStereocenterCount: __
HeavyAtomCount: 75
HydrogenBondAcceptorCount: 20
HydrogenBondDonorCount: __
RotatableBondCount: 9
Xlogp3: __
CatalogNumber:
AI56027
ChemicalName:
Tris[4,4'-di-tert-butyl-(2,2')-bipyridine]ruthenium(II) dihexafluorophosphate
CasNumber:
75777-87-6
MolecularFormula:
C54H72F12N6P2Ru
MolecularWeight:
1196.1880404000008
MdlNumber:
MFCD12022556
Smiles:
[F-][P+5]([F-])([F-])([F-])([F-])[F-].[F-][P+5]([F-])([F-])([F-])([F-])[F-].CC(C1=CC=[N]2C(=C1)C1=[N]([Ru+2]342([N]2=CC=C(C=C2C2=[N]4C=CC(=C2)C(C)(C)C)C(C)(C)C)[N]2=CC=C(C=C2C2=[N]3C=CC(=C2)C(C)(C)C)C(C)(C)C)C=CC(=C1)C(C)(C)C)(C)C
Complexity:
341
Covalently-bondedUnitCount:
6
DefinedBondStereocenterCount:
__
HeavyAtomCount:
75
HydrogenBondAcceptorCount:
20
HydrogenBondDonorCount:
__
RotatableBondCount:
9
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cc(C)c2c(c1)cn[nH]2
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cc(C)c2c(c1)cn[nH]2
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NCCS(=O)(=O)N=[N+]=[N-]
Complexity: __
Covalently-bondedUnitCount: __
DefinedBondStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCCS(=O)(=O)N=[N+]=[N-]
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedBondStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__