AA78328
1562-85-2 | Gallocyanine
Manufacturer: A2B Chem
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CatalogNumber
AA78328
ChemicalName
Gallocyanine
CasNumber
1562-85-2
MolecularFormula
C15H13ClN2O5
MolecularWeight
336.7271
MdlNumber
MFCD00011926
Smiles
Oc1cc(C(=O)O)c2c(c1O)[o+]c1c(n2)ccc(c1)N(C)C.[Cl-]
Complexity
632
Covalently-bondedUnitCount
2
HeavyAtomCount
23
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
3
RotatableBondCount
2
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CatalogNumber: AA78328
ChemicalName: Gallocyanine
CasNumber: 1562-85-2
MolecularFormula: C15H13ClN2O5
MolecularWeight: 336.7271
MdlNumber: MFCD00011926
Smiles: Oc1cc(C(=O)O)c2c(c1O)[o+]c1c(n2)ccc(c1)N(C)C.[Cl-]
Complexity: 632
Covalently-bondedUnitCount: 2
HeavyAtomCount: 23
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 3
RotatableBondCount: 2
CatalogNumber:
AA78328
ChemicalName:
Gallocyanine
CasNumber:
1562-85-2
MolecularFormula:
C15H13ClN2O5
MolecularWeight:
336.7271
MdlNumber:
MFCD00011926
Smiles:
Oc1cc(C(=O)O)c2c(c1O)[o+]c1c(n2)ccc(c1)N(C)C.[Cl-]
Complexity:
632
Covalently-bondedUnitCount:
2
HeavyAtomCount:
23
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
3
RotatableBondCount:
2
CatalogNumber: __
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Smiles: OS(=O)(=O)O.NC(=N)NCCN1CCC(=CC1)C
Complexity: __
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Smiles:
OS(=O)(=O)O.NC(=N)NCCN1CCC(=CC1)C
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Smiles: CNCCC=C1c2ccccc2[C@H]([C@H](c2c1cccc2)O)O
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CNCCC=C1c2ccccc2[C@H]([C@H](c2c1cccc2)O)O
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Smiles: ClCCS(=O)(=O)CCC(=O)N
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CatalogNumber:
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Smiles:
ClCCS(=O)(=O)CCC(=O)N
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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