AE66569
128460-74-2 | Methyl 3'-methyl[1,1'-biphenyl]-3-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE66569
ChemicalName
Methyl 3'-methyl[1,1'-biphenyl]-3-carboxylate
CasNumber
128460-74-2
MolecularFormula
C15H14O2
MolecularWeight
226.27046
MdlNumber
MFCD05979105
Smiles
COC(=O)c1cccc(c1)c1cccc(c1)C
Complexity
262
Covalently-bondedUnitCount
1
HeavyAtomCount
17
HydrogenBondAcceptorCount
2
RotatableBondCount
3
Xlogp3
4.4
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CatalogNumber: AE66569
ChemicalName: Methyl 3'-methyl[1,1'-biphenyl]-3-carboxylate
CasNumber: 128460-74-2
MolecularFormula: C15H14O2
MolecularWeight: 226.27046
MdlNumber: MFCD05979105
Smiles: COC(=O)c1cccc(c1)c1cccc(c1)C
Complexity: 262
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 2
RotatableBondCount: 3
Xlogp3: 4.4
CatalogNumber:
AE66569
ChemicalName:
Methyl 3'-methyl[1,1'-biphenyl]-3-carboxylate
CasNumber:
128460-74-2
MolecularFormula:
C15H14O2
MolecularWeight:
226.27046
MdlNumber:
MFCD05979105
Smiles:
COC(=O)c1cccc(c1)c1cccc(c1)C
Complexity:
262
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
2
RotatableBondCount:
3
Xlogp3:
4.4
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Smiles: COC(=O)c1ncc(cc1F)N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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__
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MolecularFormula:
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Smiles:
COC(=O)c1ncc(cc1F)N
Complexity:
__
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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Smiles: COC(=O)c1cc(Br)cc(c1Cl)C
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CasNumber:
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MolecularFormula:
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Smiles:
COC(=O)c1cc(Br)cc(c1Cl)C
Complexity:
__
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__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
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Smiles: CCNCc1cncc(c1)Br.Cl.Cl
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HydrogenBondAcceptorCount: __
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Xlogp3: __
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__
ChemicalName:
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CasNumber:
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MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
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Smiles:
CCNCc1cncc(c1)Br.Cl.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__