AB73921
7598-91-6 | Ethyl 5-hydroxy-2-methyl-1h-indole-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AB73921
ChemicalName
Ethyl 5-hydroxy-2-methyl-1h-indole-3-carboxylate
CasNumber
7598-91-6
MolecularFormula
C12H13NO3
MolecularWeight
219.2365
MdlNumber
MFCD00044575
Smiles
Cc1c(C(=O)OCC)c2c([nH]1)ccc(c2)O
NscNumber
405600
Complexity
269
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
2.3
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CatalogNumber: AB73921
ChemicalName: Ethyl 5-hydroxy-2-methyl-1h-indole-3-carboxylate
CasNumber: 7598-91-6
MolecularFormula: C12H13NO3
MolecularWeight: 219.2365
MdlNumber: MFCD00044575
Smiles: Cc1c(C(=O)OCC)c2c([nH]1)ccc(c2)O
NscNumber: 405600
Complexity: 269
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 2.3
CatalogNumber:
AB73921
ChemicalName:
Ethyl 5-hydroxy-2-methyl-1h-indole-3-carboxylate
CasNumber:
7598-91-6
MolecularFormula:
C12H13NO3
MolecularWeight:
219.2365
MdlNumber:
MFCD00044575
Smiles:
Cc1c(C(=O)OCC)c2c([nH]1)ccc(c2)O
NscNumber:
405600
Complexity:
269
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
2.3
CatalogNumber: AB73922
ChemicalName: Ethyl 5-hydroxypiperidine-3-carboxylate, HCl
CasNumber: 1207194-49-7
MolecularFormula: C8H16ClNO3
MolecularWeight: 209.6705
MdlNumber: MFCD14585010
Smiles: CCOC(=O)C1CNCC(C1)O.Cl
NscNumber: __
Complexity: 160
Covalently-bondedUnitCount: 2
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AB73922
ChemicalName:
Ethyl 5-hydroxypiperidine-3-carboxylate, HCl
CasNumber:
1207194-49-7
MolecularFormula:
C8H16ClNO3
MolecularWeight:
209.6705
MdlNumber:
MFCD14585010
Smiles:
CCOC(=O)C1CNCC(C1)O.Cl
NscNumber:
__
Complexity:
160
Covalently-bondedUnitCount:
2
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: AB73923
ChemicalName: Ethyl 5-methoxyindole-2-carboxylate
CasNumber: 4792-58-9
MolecularFormula: C12H13NO3
MolecularWeight: 219.2365
MdlNumber: MFCD00047163
Smiles: CCOC(=O)c1cc2c([nH]1)ccc(c2)OC
NscNumber: 30929
Complexity: 257
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 3.2
CatalogNumber:
AB73923
ChemicalName:
Ethyl 5-methoxyindole-2-carboxylate
CasNumber:
4792-58-9
MolecularFormula:
C12H13NO3
MolecularWeight:
219.2365
MdlNumber:
MFCD00047163
Smiles:
CCOC(=O)c1cc2c([nH]1)ccc(c2)OC
NscNumber:
30929
Complexity:
257
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
3.2
CatalogNumber: AB73924
ChemicalName: 5-Methyl-[1,3,4]oxadiazole-2-carboxylic acid ethyl ester
CasNumber: 37641-36-4
MolecularFormula: C6H8N2O3
MolecularWeight: 156.1393
MdlNumber: MFCD08752603
Smiles: CCOC(=O)c1nnc(o1)C
NscNumber: __
Complexity: 151
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: 0.7
CatalogNumber:
AB73924
ChemicalName:
5-Methyl-[1,3,4]oxadiazole-2-carboxylic acid ethyl ester
CasNumber:
37641-36-4
MolecularFormula:
C6H8N2O3
MolecularWeight:
156.1393
MdlNumber:
MFCD08752603
Smiles:
CCOC(=O)c1nnc(o1)C
NscNumber:
__
Complexity:
151
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
0.7