AA89617
16732-57-3 | Ethyl 5-nitroindole-2-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA89617
ChemicalName
Ethyl 5-nitroindole-2-carboxylate
CasNumber
16732-57-3
MolecularFormula
C11H10N2O4
MolecularWeight
234.2081
MdlNumber
MFCD00216477
Smiles
CCOC(=O)c1cc2c([nH]1)ccc(c2)[N+](=O)[O-]
NscNumber
131897
Complexity
315
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
3
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CatalogNumber: AA89617
ChemicalName: Ethyl 5-nitroindole-2-carboxylate
CasNumber: 16732-57-3
MolecularFormula: C11H10N2O4
MolecularWeight: 234.2081
MdlNumber: MFCD00216477
Smiles: CCOC(=O)c1cc2c([nH]1)ccc(c2)[N+](=O)[O-]
NscNumber: 131897
Complexity: 315
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 3
CatalogNumber:
AA89617
ChemicalName:
Ethyl 5-nitroindole-2-carboxylate
CasNumber:
16732-57-3
MolecularFormula:
C11H10N2O4
MolecularWeight:
234.2081
MdlNumber:
MFCD00216477
Smiles:
CCOC(=O)c1cc2c([nH]1)ccc(c2)[N+](=O)[O-]
NscNumber:
131897
Complexity:
315
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCC(=O)Oc1c(Br)cc(cc1Br)Br
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
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:
CCCCCC(=O)Oc1c(Br)cc(cc1Br)Br
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCCCCCCCCCCc1[nH]ccn1
NscNumber: __
Complexity: 148
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 5.6
CatalogNumber:
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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:
CCCCCCCCCCCc1[nH]ccn1
NscNumber:
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Complexity:
148
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
5.6
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MolecularFormula: __
MolecularWeight: __
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Smiles: [O-]S(=O)OS(=O)[O-].[K+].[K+]
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-]S(=O)OS(=O)[O-].[K+].[K+]
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__