AA74696
149506-79-6 | 4-(Dibenzylamino)cyclohexanone
Manufacturer: A2B Chem
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CatalogNumber
AA74696
ChemicalName
4-(Dibenzylamino)cyclohexanone
CasNumber
149506-79-6
MolecularFormula
C20H23NO
MolecularWeight
293.4027200000001
MdlNumber
MFCD16659682
Smiles
O=C1CCC(CC1)N(Cc1ccccc1)Cc1ccccc1
Complexity
312
Covalently-bondedUnitCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
2
RotatableBondCount
5
Xlogp3
3.5
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CatalogNumber: AA74696
ChemicalName: 4-(Dibenzylamino)cyclohexanone
CasNumber: 149506-79-6
MolecularFormula: C20H23NO
MolecularWeight: 293.4027200000001
MdlNumber: MFCD16659682
Smiles: O=C1CCC(CC1)N(Cc1ccccc1)Cc1ccccc1
Complexity: 312
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 2
RotatableBondCount: 5
Xlogp3: 3.5
CatalogNumber:
AA74696
ChemicalName:
4-(Dibenzylamino)cyclohexanone
CasNumber:
149506-79-6
MolecularFormula:
C20H23NO
MolecularWeight:
293.4027200000001
MdlNumber:
MFCD16659682
Smiles:
O=C1CCC(CC1)N(Cc1ccccc1)Cc1ccccc1
Complexity:
312
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
2
RotatableBondCount:
5
Xlogp3:
3.5
CatalogNumber: AA74697
ChemicalName: 1,3-Dimethyl 2-(4-bromophenyl)propanedioate
CasNumber: 149506-35-4
MolecularFormula: C11H11BrO4
MolecularWeight: 287.1066
MdlNumber: MFCD06204131
Smiles: COC(=O)C(c1ccc(cc1)Br)C(=O)OC
Complexity: 243
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
RotatableBondCount: 5
Xlogp3: 2.5
CatalogNumber:
AA74697
ChemicalName:
1,3-Dimethyl 2-(4-bromophenyl)propanedioate
CasNumber:
149506-35-4
MolecularFormula:
C11H11BrO4
MolecularWeight:
287.1066
MdlNumber:
MFCD06204131
Smiles:
COC(=O)C(c1ccc(cc1)Br)C(=O)OC
Complexity:
243
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
RotatableBondCount:
5
Xlogp3:
2.5
CatalogNumber: AA74698
ChemicalName: Methyl 3-(3-nitrophenyl)benzoate
CasNumber: 149506-24-1
MolecularFormula: C14H11NO4
MolecularWeight: 257.2414
MdlNumber: MFCD06803017
Smiles: COC(=O)c1cccc(c1)c1cccc(c1)[N+](=O)[O-]
Complexity: 339
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
RotatableBondCount: 3
Xlogp3: 3.2
CatalogNumber:
AA74698
ChemicalName:
Methyl 3-(3-nitrophenyl)benzoate
CasNumber:
149506-24-1
MolecularFormula:
C14H11NO4
MolecularWeight:
257.2414
MdlNumber:
MFCD06803017
Smiles:
COC(=O)c1cccc(c1)c1cccc(c1)[N+](=O)[O-]
Complexity:
339
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
RotatableBondCount:
3
Xlogp3:
3.2
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Smiles: NC1CCc2c(C1)ccc(c2)C(=O)O
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NC1CCc2c(C1)ccc(c2)C(=O)O
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