AE12017
1188265-73-7 | tert-Butyl 3-(2-hydroxyethyl)piperazine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AE12017
ChemicalName
tert-Butyl 3-(2-hydroxyethyl)piperazine-1-carboxylate
CasNumber
1188265-73-7
MolecularFormula
C11H22N2O3
MolecularWeight
230.304
MdlNumber
MFCD13152268
Smiles
OCCC1NCCN(C1)C(=O)OC(C)(C)C
Complexity
238
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
4
UndefinedAtomStereocenterCount
1
Xlogp3
0.2
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CatalogNumber: AE12017
ChemicalName: tert-Butyl 3-(2-hydroxyethyl)piperazine-1-carboxylate
CasNumber: 1188265-73-7
MolecularFormula: C11H22N2O3
MolecularWeight: 230.304
MdlNumber: MFCD13152268
Smiles: OCCC1NCCN(C1)C(=O)OC(C)(C)C
Complexity: 238
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 4
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.2
CatalogNumber:
AE12017
ChemicalName:
tert-Butyl 3-(2-hydroxyethyl)piperazine-1-carboxylate
CasNumber:
1188265-73-7
MolecularFormula:
C11H22N2O3
MolecularWeight:
230.304
MdlNumber:
MFCD13152268
Smiles:
OCCC1NCCN(C1)C(=O)OC(C)(C)C
Complexity:
238
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
4
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.2
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Smiles: O=C(N1CCC2(C1)CNCC2)OCc1ccccc1
Complexity: __
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Smiles:
O=C(N1CCC2(C1)CNCC2)OCc1ccccc1
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__
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Smiles: O=Cc1cccc(c1N)C=O
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MolecularWeight:
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Smiles:
O=Cc1cccc(c1N)C=O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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MolecularWeight: __
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Smiles: O=CC(c1ccnc(n1)SC)C#N
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=CC(c1ccnc(n1)SC)C#N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__