AA89615
16732-64-2 | 4-Bromo-1H-indole-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA89615
ChemicalName
4-Bromo-1H-indole-2-carboxylic acid
CasNumber
16732-64-2
MolecularFormula
C9H6BrNO2
MolecularWeight
240.0534
MdlNumber
MFCD21607478
Smiles
OC(=O)c1cc2c([nH]1)cccc2Br
Complexity
222
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
3
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CatalogNumber: AA89615
ChemicalName: 4-Bromo-1H-indole-2-carboxylic acid
CasNumber: 16732-64-2
MolecularFormula: C9H6BrNO2
MolecularWeight: 240.0534
MdlNumber: MFCD21607478
Smiles: OC(=O)c1cc2c([nH]1)cccc2Br
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 3
CatalogNumber:
AA89615
ChemicalName:
4-Bromo-1H-indole-2-carboxylic acid
CasNumber:
16732-64-2
MolecularFormula:
C9H6BrNO2
MolecularWeight:
240.0534
MdlNumber:
MFCD21607478
Smiles:
OC(=O)c1cc2c([nH]1)cccc2Br
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
3
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1cccc2c1cc([nH]2)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1cccc2c1cc([nH]2)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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-]
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-]
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
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCCCCC(=O)Oc1c(Br)cc(cc1Br)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__