AB50651
848482-93-9 | (S)-4-BOC-Piperazine-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AB50651
ChemicalName
(S)-4-BOC-Piperazine-2-carboxylic acid
CasNumber
848482-93-9
MolecularFormula
C10H18N2O4
MolecularWeight
230.2609
MdlNumber
MFCD02179098
Smiles
OC(=O)[C@H]1NCCN(C1)C(=O)OC(C)(C)C
Complexity
285
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
-2.2
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CatalogNumber: AB50651
ChemicalName: (S)-4-BOC-Piperazine-2-carboxylic acid
CasNumber: 848482-93-9
MolecularFormula: C10H18N2O4
MolecularWeight: 230.2609
MdlNumber: MFCD02179098
Smiles: OC(=O)[C@H]1NCCN(C1)C(=O)OC(C)(C)C
Complexity: 285
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: -2.2
CatalogNumber:
AB50651
ChemicalName:
(S)-4-BOC-Piperazine-2-carboxylic acid
CasNumber:
848482-93-9
MolecularFormula:
C10H18N2O4
MolecularWeight:
230.2609
MdlNumber:
MFCD02179098
Smiles:
OC(=O)[C@H]1NCCN(C1)C(=O)OC(C)(C)C
Complexity:
285
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
-2.2
CatalogNumber: AB50652
ChemicalName: 3-(2,2,2-Trifluoroethoxy)phenylboronic acid
CasNumber: 850593-08-7
MolecularFormula: C8H8BF3O3
MolecularWeight: 219.9535
MdlNumber: MFCD07363846
Smiles: OB(c1cccc(c1)OCC(F)(F)F)O
Complexity: 198
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AB50652
ChemicalName:
3-(2,2,2-Trifluoroethoxy)phenylboronic acid
CasNumber:
850593-08-7
MolecularFormula:
C8H8BF3O3
MolecularWeight:
219.9535
MdlNumber:
MFCD07363846
Smiles:
OB(c1cccc(c1)OCC(F)(F)F)O
Complexity:
198
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: AB50653
ChemicalName: 3-Chloro-4-(N-tert-butylcarbamoyl)phenylboronic acid
CasNumber: 850589-46-7
MolecularFormula: C11H15BClNO3
MolecularWeight: 255.5057
MdlNumber: MFCD07363771
Smiles: O=C(c1ccc(cc1Cl)B(O)O)NC(C)(C)C
Complexity: 280
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 17
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AB50653
ChemicalName:
3-Chloro-4-(N-tert-butylcarbamoyl)phenylboronic acid
CasNumber:
850589-46-7
MolecularFormula:
C11H15BClNO3
MolecularWeight:
255.5057
MdlNumber:
MFCD07363771
Smiles:
O=C(c1ccc(cc1Cl)B(O)O)NC(C)(C)C
Complexity:
280
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
17
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: C=CNC(=O)OCc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
C=CNC(=O)OCc1ccccc1
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__