AB49572
374633-27-9 | 4-Bromoindole-6-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB49572
ChemicalName
4-Bromoindole-6-carboxylic acid
CasNumber
374633-27-9
MolecularFormula
C9H6BrNO2
MolecularWeight
240.0534
MdlNumber
MFCD03095205
Smiles
OC(=O)c1cc(Br)c2c(c1)[nH]cc2
Complexity
222
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
2.3
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CatalogNumber: AB49572
ChemicalName: 4-Bromoindole-6-carboxylic acid
CasNumber: 374633-27-9
MolecularFormula: C9H6BrNO2
MolecularWeight: 240.0534
MdlNumber: MFCD03095205
Smiles: OC(=O)c1cc(Br)c2c(c1)[nH]cc2
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 2.3
CatalogNumber:
AB49572
ChemicalName:
4-Bromoindole-6-carboxylic acid
CasNumber:
374633-27-9
MolecularFormula:
C9H6BrNO2
MolecularWeight:
240.0534
MdlNumber:
MFCD03095205
Smiles:
OC(=O)c1cc(Br)c2c(c1)[nH]cc2
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
2.3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1ccc2c(c1)NCCC2=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
Clc1ccc2c(c1)NCCC2=O
Complexity:
__
Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
__
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: Nc1ccc2c(c1)cc[nH]c2=O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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MolecularFormula:
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MolecularWeight:
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Smiles:
Nc1ccc2c(c1)cc[nH]c2=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
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Smiles: CCCCN(CCCCl)CCCC
Complexity: __
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HydrogenBondAcceptorCount: __
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Smiles:
CCCCN(CCCCl)CCCC
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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