AB43401
5271-27-2 | 1-Methyl-3-phenylpiperazine
Manufacturer: A2B Chem
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CatalogNumber
AB43401
ChemicalName
1-Methyl-3-phenylpiperazine
CasNumber
5271-27-2
MolecularFormula
C11H16N2
MolecularWeight
176.2581
MdlNumber
MFCD03411603
Smiles
CN1CCNC(C1)c1ccccc1
Complexity
152
Covalently-bondedUnitCount
1
HeavyAtomCount
13
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
1
UndefinedAtomStereocenterCount
1
Xlogp3
1.1
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CatalogNumber: AB43401
ChemicalName: 1-Methyl-3-phenylpiperazine
CasNumber: 5271-27-2
MolecularFormula: C11H16N2
MolecularWeight: 176.2581
MdlNumber: MFCD03411603
Smiles: CN1CCNC(C1)c1ccccc1
Complexity: 152
Covalently-bondedUnitCount: 1
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
UndefinedAtomStereocenterCount: 1
Xlogp3: 1.1
CatalogNumber:
AB43401
ChemicalName:
1-Methyl-3-phenylpiperazine
CasNumber:
5271-27-2
MolecularFormula:
C11H16N2
MolecularWeight:
176.2581
MdlNumber:
MFCD03411603
Smiles:
CN1CCNC(C1)c1ccccc1
Complexity:
152
Covalently-bondedUnitCount:
1
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
UndefinedAtomStereocenterCount:
1
Xlogp3:
1.1
CatalogNumber: AB43402
ChemicalName: 2-(4-Methylpiperazino)pyridine-4-boronic acid pinacol ester
CasNumber: 832114-09-7
MolecularFormula: C16H26BN3O2
MolecularWeight: 303.2075
MdlNumber: MFCD05864305
Smiles: CN1CCN(CC1)c1nccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 381
Covalently-bondedUnitCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AB43402
ChemicalName:
2-(4-Methylpiperazino)pyridine-4-boronic acid pinacol ester
CasNumber:
832114-09-7
MolecularFormula:
C16H26BN3O2
MolecularWeight:
303.2075
MdlNumber:
MFCD05864305
Smiles:
CN1CCN(CC1)c1nccc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
381
Covalently-bondedUnitCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Cn1ncc(c1)B1OC(C(O1)(C)C)(C)C
Complexity: 242
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Cn1ncc(c1)B1OC(C(O1)(C)C)(C)C
Complexity:
242
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: AB43404
ChemicalName: 1-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole-3-carbaldehyde
CasNumber: 887475-64-1
MolecularFormula: C11H17BN2O3
MolecularWeight: 236.0753
MdlNumber: MFCD16659788
Smiles: O=Cc1nn(cc1B1OC(C(O1)(C)C)(C)C)C
Complexity: 306
Covalently-bondedUnitCount: 1
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: __
RotatableBondCount: 2
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
AB43404
ChemicalName:
1-Methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole-3-carbaldehyde
CasNumber:
887475-64-1
MolecularFormula:
C11H17BN2O3
MolecularWeight:
236.0753
MdlNumber:
MFCD16659788
Smiles:
O=Cc1nn(cc1B1OC(C(O1)(C)C)(C)C)C
Complexity:
306
Covalently-bondedUnitCount:
1
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
__
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
__
Xlogp3:
__