AA91114
169037-23-4 | 5-(Trifluoromethoxy)indoline-2,3-dione
Manufacturer: A2B Chem
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CatalogNumber
AA91114
ChemicalName
5-(Trifluoromethoxy)indoline-2,3-dione
CasNumber
169037-23-4
MolecularFormula
C9H4F3NO3
MolecularWeight
231.1281696
MdlNumber
MFCD00192524
Smiles
O=C1Nc2c(C1=O)cc(cc2)OC(F)(F)F
Complexity
329
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
6
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.8
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CatalogNumber: AA91114
ChemicalName: 5-(Trifluoromethoxy)indoline-2,3-dione
CasNumber: 169037-23-4
MolecularFormula: C9H4F3NO3
MolecularWeight: 231.1281696
MdlNumber: MFCD00192524
Smiles: O=C1Nc2c(C1=O)cc(cc2)OC(F)(F)F
Complexity: 329
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.8
CatalogNumber:
AA91114
ChemicalName:
5-(Trifluoromethoxy)indoline-2,3-dione
CasNumber:
169037-23-4
MolecularFormula:
C9H4F3NO3
MolecularWeight:
231.1281696
MdlNumber:
MFCD00192524
Smiles:
O=C1Nc2c(C1=O)cc(cc2)OC(F)(F)F
Complexity:
329
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.8
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C1Nc2c(C1=O)c(F)c(cc2)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1Nc2c(C1=O)c(F)c(cc2)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=Cc1cccn1c1ccc(cc1)C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=Cc1cccn1c1ccc(cc1)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA91118
ChemicalName: (2S,4S)-1-tert-Butyl 2-methyl 4-chloropyrrolidine-1,2-dicarboxylate
CasNumber: 169032-99-9
MolecularFormula: C11H18ClNO4
MolecularWeight: 263.71791999999994
MdlNumber: MFCD09029703
Smiles: COC(=O)[C@@H]1C[C@@H](CN1C(=O)OC(C)(C)C)Cl
Complexity: 313
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 4
Xlogp3: 1.9
CatalogNumber:
AA91118
ChemicalName:
(2S,4S)-1-tert-Butyl 2-methyl 4-chloropyrrolidine-1,2-dicarboxylate
CasNumber:
169032-99-9
MolecularFormula:
C11H18ClNO4
MolecularWeight:
263.71791999999994
MdlNumber:
MFCD09029703
Smiles:
COC(=O)[C@@H]1C[C@@H](CN1C(=O)OC(C)(C)C)Cl
Complexity:
313
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
4
Xlogp3:
1.9