AB52046
13544-09-7 | 6-(Trifluoromethyl)indole-3-carboxaldehyde
Manufacturer: A2B Chem
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CatalogNumber
AB52046
ChemicalName
6-(Trifluoromethyl)indole-3-carboxaldehyde
CasNumber
13544-09-7
MolecularFormula
C10H6F3NO
MolecularWeight
213.1559
MdlNumber
MFCD09954784
Smiles
O=Cc1c[nH]c2c1ccc(c2)C(F)(F)F
Complexity
254
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
2.6
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CatalogNumber: AB52046
ChemicalName: 6-(Trifluoromethyl)indole-3-carboxaldehyde
CasNumber: 13544-09-7
MolecularFormula: C10H6F3NO
MolecularWeight: 213.1559
MdlNumber: MFCD09954784
Smiles: O=Cc1c[nH]c2c1ccc(c2)C(F)(F)F
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AB52046
ChemicalName:
6-(Trifluoromethyl)indole-3-carboxaldehyde
CasNumber:
13544-09-7
MolecularFormula:
C10H6F3NO
MolecularWeight:
213.1559
MdlNumber:
MFCD09954784
Smiles:
O=Cc1c[nH]c2c1ccc(c2)C(F)(F)F
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CO[C@@H]([C@@H]1CCCN1C(=O)OC(C)(C)C)[C@H](C(=O)O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CO[C@@H]([C@@H]1CCCN1C(=O)OC(C)(C)C)[C@H](C(=O)O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1c[nH]c2c1c(C#N)ccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1c[nH]c2c1c(C#N)ccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB52049
ChemicalName: 5-(Trifluoromethyl)-1h-indole-3-carboxaldehyde
CasNumber: 468718-16-3
MolecularFormula: C10H6F3NO
MolecularWeight: 213.1559
MdlNumber: MFCD09954785
Smiles: O=Cc1c[nH]c2c1cc(cc2)C(F)(F)F
Complexity: 254
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 2.6
CatalogNumber:
AB52049
ChemicalName:
5-(Trifluoromethyl)-1h-indole-3-carboxaldehyde
CasNumber:
468718-16-3
MolecularFormula:
C10H6F3NO
MolecularWeight:
213.1559
MdlNumber:
MFCD09954785
Smiles:
O=Cc1c[nH]c2c1cc(cc2)C(F)(F)F
Complexity:
254
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
2.6