AA09407
10242-01-0 | 5-Methoxyindole-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA09407
ChemicalName
5-Methoxyindole-3-carboxylic acid
CasNumber
10242-01-0
MolecularFormula
C10H9NO3
MolecularWeight
191.1834
MdlNumber
MFCD03265451
Smiles
COc1ccc2c(c1)c(c[nH]2)C(=O)O
NscNumber
88877
Complexity
231
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
2
Xlogp3
2
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CatalogNumber: AA09407
ChemicalName: 5-Methoxyindole-3-carboxylic acid
CasNumber: 10242-01-0
MolecularFormula: C10H9NO3
MolecularWeight: 191.1834
MdlNumber: MFCD03265451
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)O
NscNumber: 88877
Complexity: 231
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 2
CatalogNumber:
AA09407
ChemicalName:
5-Methoxyindole-3-carboxylic acid
CasNumber:
10242-01-0
MolecularFormula:
C10H9NO3
MolecularWeight:
191.1834
MdlNumber:
MFCD03265451
Smiles:
COc1ccc2c(c1)c(c[nH]2)C(=O)O
NscNumber:
88877
Complexity:
231
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
2
CatalogNumber: AA09408
ChemicalName: 6-Nitro-1h-indole-2-carboxylic acid
CasNumber: 10242-00-9
MolecularFormula: C9H6N2O4
MolecularWeight: 206.1549
MdlNumber: MFCD02664466
Smiles: [O-][N+](=O)c1ccc2c(c1)[nH]c(c2)C(=O)O
NscNumber: __
Complexity: 288
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 2.1
CatalogNumber:
AA09408
ChemicalName:
6-Nitro-1h-indole-2-carboxylic acid
CasNumber:
10242-00-9
MolecularFormula:
C9H6N2O4
MolecularWeight:
206.1549
MdlNumber:
MFCD02664466
Smiles:
[O-][N+](=O)c1ccc2c(c1)[nH]c(c2)C(=O)O
NscNumber:
__
Complexity:
288
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(n1cncc1)Nc1cccc(c1)C(F)(F)F
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(n1cncc1)Nc1cccc(c1)C(F)(F)F
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O[C@@H]1C=Cc2c([C@H]1O)ccc1c2cc2ccc3c(c2n1)cccc3
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O[C@@H]1C=Cc2c([C@H]1O)ccc1c2cc2ccc3c(c2n1)cccc3
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__