AE08971
118577-00-7 | 2-(2-Methoxyphenyl)piperidine
Manufacturer: A2B Chem
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CatalogNumber
AE08971
ChemicalName
2-(2-Methoxyphenyl)piperidine
CasNumber
118577-00-7
MolecularFormula
C12H17NO
MolecularWeight
191.2695
MdlNumber
MFCD02663553
Smiles
COc1ccccc1C1CCCCN1
Complexity
172
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
2.1
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CatalogNumber: AE08971
ChemicalName: 2-(2-Methoxyphenyl)piperidine
CasNumber: 118577-00-7
MolecularFormula: C12H17NO
MolecularWeight: 191.2695
MdlNumber: MFCD02663553
Smiles: COc1ccccc1C1CCCCN1
Complexity: 172
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 2.1
CatalogNumber:
AE08971
ChemicalName:
2-(2-Methoxyphenyl)piperidine
CasNumber:
118577-00-7
MolecularFormula:
C12H17NO
MolecularWeight:
191.2695
MdlNumber:
MFCD02663553
Smiles:
COc1ccccc1C1CCCCN1
Complexity:
172
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
2.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: COC1=C(C=C(C=C1)C2=CSC(=N2)N)F.Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
COC1=C(C=C(C=C1)C2=CSC(=N2)N)F.Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AE08973
ChemicalName: Methyl 6-cyano-1h-indole-2-carboxylate
CasNumber: 104291-83-0
MolecularFormula: C11H8N2O2
MolecularWeight: 200.1934
MdlNumber: MFCD07375393
Smiles: COC(=O)c1cc2c([nH]1)cc(cc2)C#N
Complexity: 307
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: 2.2
CatalogNumber:
AE08973
ChemicalName:
Methyl 6-cyano-1h-indole-2-carboxylate
CasNumber:
104291-83-0
MolecularFormula:
C11H8N2O2
MolecularWeight:
200.1934
MdlNumber:
MFCD07375393
Smiles:
COC(=O)c1cc2c([nH]1)cc(cc2)C#N
Complexity:
307
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
2.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CCN1C(=O)C[C@H]([C@@H]1c1ccccc1OC)C(=O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CCN1C(=O)C[C@H]([C@@H]1c1ccccc1OC)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__