AB28362
25957-65-7 | 1H-Pyrrolo[2,3-c]pyridine-3-carbaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AB28362
ChemicalName
1H-Pyrrolo[2,3-c]pyridine-3-carbaldehyde
CasNumber
25957-65-7
MolecularFormula
C8H6N2O
MolecularWeight
146.146
MdlNumber
MFCD10000953
Smiles
O=Cc1c[nH]c2c1ccnc2
Complexity
160
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
0.4
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CatalogNumber: AB28362
ChemicalName: 1H-Pyrrolo[2,3-c]pyridine-3-carbaldehyde
CasNumber: 25957-65-7
MolecularFormula: C8H6N2O
MolecularWeight: 146.146
MdlNumber: MFCD10000953
Smiles: O=Cc1c[nH]c2c1ccnc2
Complexity: 160
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 0.4
CatalogNumber:
AB28362
ChemicalName:
1H-Pyrrolo[2,3-c]pyridine-3-carbaldehyde
CasNumber:
25957-65-7
MolecularFormula:
C8H6N2O
MolecularWeight:
146.146
MdlNumber:
MFCD10000953
Smiles:
O=Cc1c[nH]c2c1ccnc2
Complexity:
160
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
0.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCOc1nccc(=O)[nH]1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCOc1nccc(=O)[nH]1
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Nc1c2C(=O)c3ccccc3C(=O)c2c(cc1S(=O)(=O)O)Nc1cc(cc(c1C)N)S(=O)(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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Smiles:
Nc1c2C(=O)c3ccccc3C(=O)c2c(cc1S(=O)(=O)O)Nc1cc(cc(c1C)N)S(=O)(=O)O
Complexity:
__
Covalently-bondedUnitCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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CatalogNumber: AB28366
ChemicalName: Allura Red AC
CasNumber: 25956-17-6
MolecularFormula: C18H14N2Na2O8S2
MolecularWeight: 496.4219
MdlNumber: MFCD00059526
Smiles: COc1cc(c(cc1/N=N/c1c(O)ccc2c1ccc(c2)S(=O)(=O)[O-])C)S(=O)(=O)[O-].[Na+].[Na+]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB28366
ChemicalName:
Allura Red AC
CasNumber:
25956-17-6
MolecularFormula:
C18H14N2Na2O8S2
MolecularWeight:
496.4219
MdlNumber:
MFCD00059526
Smiles:
COc1cc(c(cc1/N=N/c1c(O)ccc2c1ccc(c2)S(=O)(=O)[O-])C)S(=O)(=O)[O-].[Na+].[Na+]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__