AB69297
21598-06-1 | 5-Hydroxyindole-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB69297
ChemicalName
5-Hydroxyindole-2-carboxylic acid
CasNumber
21598-06-1
MolecularFormula
C9H7NO3
MolecularWeight
177.1568
MdlNumber
MFCD00005615
Smiles
Oc1ccc2c(c1)cc([nH]2)C(=O)O
NscNumber
117338
Complexity
219
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
3
RotatableBondCount
1
Xlogp3
2
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CatalogNumber: AB69297
ChemicalName: 5-Hydroxyindole-2-carboxylic acid
CasNumber: 21598-06-1
MolecularFormula: C9H7NO3
MolecularWeight: 177.1568
MdlNumber: MFCD00005615
Smiles: Oc1ccc2c(c1)cc([nH]2)C(=O)O
NscNumber: 117338
Complexity: 219
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 1
Xlogp3: 2
CatalogNumber:
AB69297
ChemicalName:
5-Hydroxyindole-2-carboxylic acid
CasNumber:
21598-06-1
MolecularFormula:
C9H7NO3
MolecularWeight:
177.1568
MdlNumber:
MFCD00005615
Smiles:
Oc1ccc2c(c1)cc([nH]2)C(=O)O
NscNumber:
117338
Complexity:
219
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
1
Xlogp3:
2
CatalogNumber: AB69298
ChemicalName: 5-Hydroxy-1-indanone
CasNumber: 3470-49-3
MolecularFormula: C9H8O2
MolecularWeight: 148.1586
MdlNumber: MFCD00857527
Smiles: Oc1ccc2c(c1)CCC2=O
NscNumber: 31249
Complexity: 176
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 1.3
CatalogNumber:
AB69298
ChemicalName:
5-Hydroxy-1-indanone
CasNumber:
3470-49-3
MolecularFormula:
C9H8O2
MolecularWeight:
148.1586
MdlNumber:
MFCD00857527
Smiles:
Oc1ccc2c(c1)CCC2=O
NscNumber:
31249
Complexity:
176
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
1.3
CatalogNumber: AB69299
ChemicalName: 5-Hydroxy-1-tetralone
CasNumber: 28315-93-7
MolecularFormula: C10H10O2
MolecularWeight: 162.1852
MdlNumber: MFCD00001693
Smiles: O=C1CCCc2c1cccc2O
NscNumber: __
Complexity: 188
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 2.1
CatalogNumber:
AB69299
ChemicalName:
5-Hydroxy-1-tetralone
CasNumber:
28315-93-7
MolecularFormula:
C10H10O2
MolecularWeight:
162.1852
MdlNumber:
MFCD00001693
Smiles:
O=C1CCCc2c1cccc2O
NscNumber:
__
Complexity:
188
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COc1cc2oc(cc(=O)c2c(c1OC)O)c1ccc(c(c1)O)OC
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COc1cc2oc(cc(=O)c2c(c1OC)O)c1ccc(c(c1)O)OC
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__